# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-24T15:39:56+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'J. Mater. Chem.') 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
"1000442","4.8437","0.0002","8.33","0.0003","8.9547","0.0004","90","","90","","90","","361.3","","","","","","","","","","","","","2","P n a 21","P 2c -2n","33","","Aluminium oxide - κ","","- Al2 O3 -","- Al2 O3 -","- Al16 O24 -","8","2","","Ollivier, Benoist; Retoux, Richard; Lacorre, Philippe; Massiot, Dominique; Férey, Gérard","Crystal structure of κ-alumina: an X-ray powder diffraction, TEM and NMR study","Journal of Materials Chemistry","1997","7","6","1049","1056","10.1039/a700054e","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","202026","2020-10-21","18:00:00",""
"1001669","4.848","0.001","6.892","0.001","8.077","0.002","92.65","0.01","93.26","0.01","106.23","0.01","258.2","","","","","","","","","","","","","4","P -1","-P 1","2","","Mercury divanadium(III) bis(diphosphate)","","- Hg O14 P4 V2 -","- Hg O14 P4 V2 -","- Hg O14 P4 V2 -","1","0.5","","Boudin, S; Grandin, A; Leclaire, A; Borel, M M; Raveau, B","Two new diphosphates with Sr V2 (P2 O7)2 structure: mercury and lead phases","Journal of Materials Chemistry","1994","4","12","1889","1892","10.1039/jm9940401889","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001670","4.804","0.001","7.113","0.001","7.898","0.002","89.78","0.01","92.62","0.01","106.1","0.02","259","","","","","","","","","","","","","4","P -1","-P 1","2","","Lead divanadium(III) bis(diphosphate)","","- O14 P4 Pb V2 -","- O14 P4 Pb V2 -","- O14 P4 Pb V2 -","1","0.5","","Boudin, S; Grandin, A; Leclaire, A; Borel, M M; Raveau, B","Two new diphosphates with Sr V2 (P2 O7)2 structure: mercury and lead phases","Journal of Materials Chemistry","1994","4","12","1889","1892","10.1039/jm9940401889","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001671","4.237","0.001","3.7675","0.0006","11.917","0.007","90","","90","","90","","190.2","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","Neodymium copper oxide (2/1/3.5)","","- Cu Nd2 O3.5 -","- Cu Nd2 O3.5 -","- Cu2 Nd4 O7 -","2","0.125","","Choisnet, J; Mouron, M; Crespin, M; van Aken, P A; Mueller, W F","Perovskite-like intergrowth structure of the reduced cuprate Nd2 Cu O3.5: a combination of defect and excess oxygen non-stoichiometry phenomena","Journal of Materials Chemistry","1994","4","6","895","898","10.1039/jm9940400895","","","","","","0.061","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001710","5.4604","0.0003","5.5227","0.0003","12.2112","0.0006","90","","90","","90","","368.2","","","","","","","","","","","","","5","C m m m","-C 2 2","65","","Dilead distrontium copper(I) iron(III) oxide","","- Cu Fe O6 Pb2 Sr2 -","- Cu Fe O6 Pb2 Sr2 -","- Cu2 Fe2 O12 Pb4 Sr4 -","2","0.125","","Rouillon, T; Caldes, M T; Genouel, R; Michel, C; Hervieu, M; Raveau, B","An ordered oxygen deficient K2 Ni F4 structure: Pb2 Sr2 Cu Fe O6","Journal of Materials Chemistry","1995","5","8","1163","1170","10.1039/jm9950501163","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001711","5.4606","0.0003","5.5228","0.0003","12.2112","0.0006","90","","90","","90","","368.3","","","","","","","","","","","","","5","P 2 a n","P -2ab 2","30","","Dilead distrontium copper(I) iron(III) oxide","","- Cu Fe O6 Pb2 Sr2 -","- Cu Fe O6 Pb2 Sr2 -","- Cu2 Fe2 O12 Pb4 Sr4 -","2","0.5","","Rouillon, T; Caldes, M T; Genouel, R; Michel, C; Hervieu, M; Raveau, B","An ordered oxygen deficient K2 Ni F4 structure: Pb2 Sr2 Cu Fe O6","Journal of Materials Chemistry","1995","5","8","1163","1170","10.1039/jm9950501163","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001712","5.4604","0.0003","5.5227","0.0003","12.211","0.0006","90","","90","","90","","368.2","","","","","","","","","","","","","5","P 21 a m","P -2 2a","26","","Dilead distrontium copper(I) iron(III) oxide","","- Cu Fe O6 Pb2 Sr2 -","- Cu Fe O6 Pb2 Sr2 -","- Cu2 Fe2 O12 Pb4 Sr4 -","2","0.5","","Rouillon, T; Caldes, M T; Genouel, R; Michel, C; Hervieu, M; Raveau, B","An ordered oxygen deficient K2 Ni F4 structure: Pb2 Sr2 Cu Fe O6","Journal of Materials Chemistry","1995","5","8","1163","1170","10.1039/jm9950501163","","","","","","0.061","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004109","9.477","0.001","9.477","0.001","7.825","0.004","90","","90","","120","","608.6","","","","","","","","","","","","","3","P 3 2 1","P 3 2""","150","","Tetrastrontium nonaoxotriniccolate","","- Ni3 O9 Sr4 -","- Ni3 O9 Sr4 -","- Ni9 O27 Sr12 -","3","0.5","","Abraham, F; Minaud, S; Renard, C","Preliminary crystal structure of mixed-valency Sr4 Ni3 O9, the actual formula of the so-called Sr5 Ni4 O11","Journal of Materials Chemistry","1994","4","11","1763","1764","10.1039/jm9940401763","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004117","7.28296","0.00009","7.28296","0.00009","6.43407","0.0001","90","","90","","90","","341.3","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Europium bismuth vanadate (0.28/0.72/1)","","- Bi0.72 Eu0.28 O4 V -","- Bi0.72 Eu0.28 O4 V -","- Bi2.88 Eu1.12 O16 V4 -","4","0.25","","Blin, J L; Lorriaux-Rubbens, A; Wallart, F; Wignacourt, J P","Synthesis and structural investigation of the Eu1-x Bix V O4 scheelite phase: X-ray diffraction, Raman scattering and Eu(3+) luminescence","Journal of Materials Chemistry","1996","6","3","385","389","10.1039/jm9960600385","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004130","7.28296","0.00009","7.28296","0.00009","6.43407","0.0001","90","","90","","90","","341.3","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Europium bismuth vanadate (0.28/0.72/1)","","- Bi0.72 Eu0.28 O4 V -","- Bi0.72 Eu0.28 O4 V -","- Bi2.88 Eu1.12 O16 V4 -","4","0.125","","Blin, J L; Lorriaux-Rubbens, A; Wallart, F; Wignacourt, J P","Synthesis and structural investigation of the Eu1-x Bix V O4 scheelite phase: X-ray diffraction, Raman scattering and Eu(3+) luminescence","Journal of Materials Chemistry","1996","6","3","385","389","10.1039/jm9960600385","","","","","","0.025","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1006097","5.6262","0.0006","7.8396","0.0008","5.5702","0.0006","90","","90","","90","","245.7","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Dilanthanum copper titanium oxide","","- Cu La2 O6 Ti -","- Cu0.992 La2 O6 Ti1.008 -","- Cu1.984 La4 O12 Ti2.016 -","2","0.25","","Palacin, M R; Bassas, J; Rodriguez-Carvajal, J; Gomez-Romero, P","Syntheses of the perovskite La2 Cu Ti O6 by the ceramic, oxide precursors and sol-gel methods, and study of the structure and Cu-Ti distribution by X-ray and neutron diffraction","Journal of Materials Chemistry","1993","3","3","1171","1177","10.1039/jm9930301171","","","","","","0.078","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008525","14.323","0.003","7.106","0.002","15.795","0.003","90","","90.3","0.02","90","","1607.6","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Tetrapotassium phyllo-hexaarsenidotetraindate","","- As6 In4 K4 -","- As6 In4 K4 -","- As24 In16 K16 -","4","1","","Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J","Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb","Journal of Materials Chemistry","1991","1","4","555","558","10.1039/jm9910100555","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008526","15.288","0.005","7.544","0.001","16.79","0.003","90","","90.54","0.02","90","","1936.3","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Tetrapotassium phyllo-hexaantimonidotetraindate","","- In4 K4 Sb6 -","- In4 K4 Sb6 -","- In16 K16 Sb24 -","4","1","","Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J","Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb","Journal of Materials Chemistry","1991","1","4","555","558","10.1039/jm9910100555","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008901","15.9634","0.0005","7.8502","0.0002","10.8664","0.0003","90","","97.931","0.002","90","","1348.7","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tricerium bis(tetrathiosilicate) iodide","","- Ce3 I S8 Si2 -","- Ce3 I S8 Si2 -","- Ce12 I4 S32 Si8 -","4","0.5","","Gauthier, G; Kawasaki, S; Jobic, S; Macaudiere, P; Brec, R; Rouxel, J","Characterization of Ce3 (Si S4)2 I, a compound with a new structure type","Journal of Materials Chemistry","1998","8","1","179","186","10.1039/a704702i","","","","","","0.022","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1513969","8.24609","0.00014","8.24609","0.00014","8.24609","0.00014","90","","90","","90","","560.718","0.016","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.87)","","- Li Mn2 O3.868 -","- Li Mn2 O3.8664 -","- Li8 Mn16 O30.9312 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","13","1948","1958","10.1039/B314810F","","","","","","0.0422","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"2000133","10.043","0.007","10.043","0.007","13.828","0.01","90","","90","","90","","1394.7","1.7","293","2","293","2","","","","","","","","7","P 42/n c m :2","-P 4ac 2ac","138","","","","- C2 H16 F3 Ga3 N2 O12 P2 -","- C2 H16 F3 Ga3 N2 O12 P2 -","- C8 H64 F12 Ga12 N8 O48 P8 -","4","0.25","","Matijasic, Alain; Gramlich, Volker; Patarin, Joël","Further evidence of the efficiency of the fluoride route illustrated by the hydrothermal synthesis and crystal structure of the hydroxyfluorogallophosphate Mu-20","Journal of Materials Chemistry","2001","11","10","2553","","10.1039/b102263f","","","1.54178","CuKα","","0.0354","0.0322","","0.0938","0.0916","","","","1.259","1.296","1.296","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"6000062","5.9888","","5.9916","","8.4667","","90","","90.026","","90","","303.81","","","","100","","","","","","","","","4","P 1 21/n 1","","","","","","- Ba2 Nd O6 Ru -","","","","","","Izumiyama, Y.; Doi, Y.; Wakeshima, M.; Hinatsu, Y.; Oikawa, K.; Shimojo, Y.; Morii, Y.","Magnetic and neutron diffraction studies of the ordered perovskite Ba2NdRuO6","Journal of Materials Chemistry","2000","10","","2364","2367","10.1039/b003629n","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000095","11.48","","11.48","","87.46","","90","","90","","120","","9982.15","","","","","","","","","","","","","4","R 3","","","","","","- H3 Mo12 O40 P -","","","","","","Marosi, L.; Platero, E. E.; Cifre, J.; Arean, C. O.","Thermal dehydration of H3+xPVxM12-xO40 center dot yH(2)O Keggin type heteropolyacids; formation, thermal stability and structure of the anhydrous acids H3PM12O40, of the corresponding anhydrides PM12O38.5 and of a novel trihydrate H3PW12O40 3H(2)O","Journal of Materials Chemistry","2000","10","","1949","1955","10.1039/b001476l","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000127","13.382","0.002","13.382","0.002","13.382","0.002","90","","90","","90","","2396.4","0.6","296","2","296","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- Al12 Ce10 N36 O18 Si18 Sr3 -","- Al12 Ce9.96 N36 O18 Si18 Sr3.04 -","- Al24 Ce19.92 N72 O36 Si36 Sr6.08 -","2","0.0416667","","Lauterbach, Rainer; Irran, Elisabeth; Henry, Paul F.; Weller, Mark T.; Schnick, Wolfgang","High-temperature synthesis, single-crystal X-ray and neutron powder diffraction, and materials properties of Sr3Ln10Si18Al12O18N36 (Ln = Ce, Pr, Nd)—novel sialons with an ordered distribution of Si, Al, O, and N","Journal of Materials Chemistry","2000","10","6","1357","1364","10.1039/a908844j","","","0.71073","MoKα","","0.0333","0.0298","","","0.0708","0.074","","","","","","1.116","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000128","13.3454","0.0006","13.3454","0.0006","13.3454","0.0006","90","","90","","90","","2376.81","0.19","293","2","293","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- Al12 N36 O18 Pr10 Si18 Sr3 -","- Al12 N36 O18 Pr9.96 Si18 Sr3.04 -","- Al24 N72 O36 Pr19.92 Si36 Sr6.08 -","2","0.0416667","","Lauterbach, Rainer; Irran, Elisabeth; Henry, Paul F.; Weller, Mark T.; Schnick, Wolfgang","High-temperature synthesis, single-crystal X-ray and neutron powder diffraction, and materials properties of Sr3Ln10Si18Al12O18N36 (Ln = Ce, Pr, Nd)—novel sialons with an ordered distribution of Si, Al, O, and N","Journal of Materials Chemistry","2000","10","6","1357","1364","10.1039/a908844j","","","0.71073","MoKα","","0.0296","0.0261","","","0.0627","0.0646","","","","","","1.093","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000129","13.3285","0.0006","13.3285","0.0006","13.3285","0.0006","90","","90","","90","","2367.79","0.18","293","2","293","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- Al12 N36 Nd10 O18 Si18 Sr3 -","- Al12 N36 Nd9.96 O18 Si18 Sr3.04 -","- Al24 N72 Nd19.92 O36 Si36 Sr6.08 -","2","0.0416667","","Lauterbach, Rainer; Irran, Elisabeth; Henry, Paul F.; Weller, Mark T.; Schnick, Wolfgang","High-temperature synthesis, single-crystal X-ray and neutron powder diffraction, and materials properties of Sr3Ln10Si18Al12O18N36 (Ln = Ce, Pr, Nd)—novel sialons with an ordered distribution of Si, Al, O, and N","Journal of Materials Chemistry","2000","10","6","1357","1364","10.1039/a908844j","","","0.71073","MoKα","","0.0271","0.0249","","","0.0494","0.0501","","","","","","1.117","","","","has coordinates","176428","2020-10-21","18:00:00",""
"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",""
"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",""
"6000375","8.1174","","15.1841","","19.8803","","90","","93.762","","90","","2445.07","","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- C15 H30 Nd2 O18 -","","","","","","Serpaggi, F.; Ferey, G.","Hybrid open frameworks (MIL-n). Part 4 - Synthesis and crystal structure of MIL-8, a series of lanthanide glutarates with an open framework, [Ln(H2O)](2)[O2C(CH2)(3)CO2](3).4H(2)O","Journal of Materials Chemistry","1998","8","","2737","2741","10.1039/a802713g","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000376","8.2141","","18.9644","","5.2622","","90","","111.999","","90","","760.04","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- C3 H7 Gd O6 P2 -","","","","","","Serpaggi, F.; Ferey, G.","Hybrid open frameworks (MIL-n). Part 6 - Hydrothermal synthesis and X-ray powder ab initio structure determination of MIL-11, a series of lanthanide organodiphosphonates with three-dimensional networks, Ln(III)H[O3P(CH2)(n)PO3](n = 1-3)","Journal of Materials Chemistry","1998","8","","2749","2755","10.1039/a802715c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000377","5.2918","","15.975","","8.338","","90","","111.491","","90","","655.86","","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C2 H5 Ga O6 P2 -","","","","","","Serpaggi, F.; Ferey, G.","Hybrid open frameworks (MIL-n). Part 6 - Hydrothermal synthesis and X-ray powder ab initio structure determination of MIL-11, a series of lanthanide organodiphosphonates with three-dimensional networks, Ln(III)H[O3P(CH2)(n)PO3](n = 1-3)","Journal of Materials Chemistry","1998","8","","2749","2755","10.1039/a802715c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000378","8.3271","","14.0645","","5.3489","","90","","111.433","","90","","583.12","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- C H3 O6 P2 Pr -","","","","","","Serpaggi, F.; Ferey, G.","Hybrid open frameworks (MIL-n). Part 6 - Hydrothermal synthesis and X-ray powder ab initio structure determination of MIL-11, a series of lanthanide organodiphosphonates with three-dimensional networks, Ln(III)H[O3P(CH2)(n)PO3](n = 1-3)","Journal of Materials Chemistry","1998","8","","2749","2755","10.1039/a802715c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000388","11.2728","","11.2728","","9.803","","90","","90","","90","","1245.73","","","","","","","","","","","","","3","I 41/a","","","","","","- Mn3 O8 Ta2 -","","","","","","Esmaeilzadeh, S.; Grins, J.; Fitch, A.","Determination of the fluorite related structure of Mn3Ta2O8, using synchrotron X-ray powder and electron diffraction data","Journal of Materials Chemistry","1998","8","","2493","2497","10.1039/a804938k","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000423","5.5593","","5.4151","","11.773","","90","","90.144","","90","","354.42","","","","","","","","","","","","","3","P 1 21 1","","","","","","- Co3 La3 O8 -","","","","","","Hansteen, O. H.; Fjellvag, H.; Hauback, B. C.","Crystal structure, thermal and magnetic properties of La3Co3O8. Phase relations for LaCoO3-delta (0.00 <=delta <= 0.50) at 673 k","Journal of Materials Chemistry","1998","8","","2081","2088","10.1039/a801796d","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000424","5.4572","","28.553","","5.6542","","90","","90","","90","","881.03","","","","","","","","","","","","","3","P n m a","","","","","","- Co3 La4 O9 -","","","","","","Hansteen, O. H.; Fjellvag, H.; Hauback, B. C.","Crystal structure, thermal and magnetic properties of La4Co3O9. Phase relations for La4Co3O10-delta (0.00 <=delta <= 1.00) at 673 k","Journal of Materials Chemistry","1998","8","","2089","2093","10.1039/a801798k","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000442","11.0763","","11.0763","","11.0763","","90","","90","","90","","1358.9","","","","","","","","","","","","","3","F d -3 m","","","","","","- Fe Mo3 N -","","","","","","Alconchel, S.; Sapina, F.; Beltran, D.; Beltran, A.","Chemistry of interstitial molybdenum ternary nitrides MnMo3N (M = Fe, Co, n = 3; m = Ni, n = 2)","Journal of Materials Chemistry","1998","8","","1901","1909","10.1039/a801643g","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000443","11.024","","11.024","","11.024","","90","","90","","90","","1339.72","","","","","","","","","","","","","3","F d -3 m","","","","","","- Co Mo3 N -","","","","","","Alconchel, S.; Sapina, F.; Beltran, D.; Beltran, A.","Chemistry of interstitial molybdenum ternary nitrides MnMo3N (M = Fe, Co, n = 3; m = Ni, n = 2)","Journal of Materials Chemistry","1998","8","","1901","1909","10.1039/a801643g","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000444","6.6342","","6.6342","","6.6342","","90","","90","","90","","291.99","","","","","","","","","","","","","3","P 41 3 2","","","","","","- Mo3 N Ni2 -","","","","","","Alconchel, S.; Sapina, F.; Beltran, D.; Beltran, A.","Chemistry of interstitial molybdenum ternary nitrides MnMo3N (M = Fe, Co, n = 3; m = Ni, n = 2)","Journal of Materials Chemistry","1998","8","","1901","1909","10.1039/a801643g","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000465","9.2769","","14.798","","14.611","","90","","90","","90","","2005.79","","","","","","","","","","","","","7","P b c m","","","","","","- C4 H16 Al3 Mg N3 O17 P4 -","","","","","","Kongshaug, K. O.; Fjellvag, H.; Lillerud, K. P.","Synthesis and characterization of the open-framework magnesium aluminophosphate UiO-28","Journal of Materials Chemistry","2001","11","","1242","1247","10.1039/b008728i","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000466","9.2186","","14.8652","","14.5811","","90","","90","","90","","1998.14","","","","","","","","","","","","","7","P b c m","","","","","","- C4 H14 Al3 Mg N3 O16 P4 -","","","","","","Kongshaug, K. O.; Fjellvag, H.; Lillerud, K. P.","Synthesis and characterization of the open-framework magnesium aluminophosphate UiO-28","Journal of Materials Chemistry","2001","11","","1242","1247","10.1039/b008728i","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000518","8.8107","","10.2258","","20.9082","","90","","90","","90","","1883.75","","","","","","","","","","","","","7","P 21 21 21","","","","","","- C5 H19 F3 Ga3 N3 O12 P3 -","","","","","","Paulet, C.; Loiseau, T.; Ferey, G.","Hydrothermal synthesis (in water-dimethylformamide) and crystal structure of MIL-30, a new layered fluorinated gallium phosphate with 1,3-diaminopropane and dimethylamine as templates","Journal of Materials Chemistry","2000","10","","1225","1229","10.1039/a909315j","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000525","13.794","","23.9","","8.4168","","90","","90","","90","","2774.82","","","","","","","","","","","","","3","P c c 2","","","","","","- Al O4 P -","","","","","","Mora, A. J.; Fitch, A. N.; Cole, M.; Goyal, R.; Jones, R. H.; Jobic, H.; Carr, S. W.","The structure of the calcined aluminophosphate AlPO(4)-5 determined by high-resolution X-ray and neutron powder diffraction","Journal of Materials Chemistry","1996","6","","1831","1835","10.1039/jm9960601831","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000545","6.9931","","6.9733","","17.6113","","90","","90","","90","","858.81","","","","","","","","","","","","","5","P 21 c n","","","","","","- D6 K O9 P U -","","","","","","Cole, M.; Fitch, A. N.; Prince, E.","Low-temperature structure of KUO2PO4.3D2O determined from combined synchrotron radiation and neutron powder diffraction measurements","Journal of Materials Chemistry","1993","3","","519","522","10.1039/jm9930300519","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000644","14.009","","14.009","","9.386","","90","","90","","120","","1595.24","","","","","","","","","","","","","4","R 3","","","","","","- As Li O4 Zn -","","","","","","Jensen, T. R.; Norby, P.; Hanson, J. C.; Simonsen, O.; Skou, E. M.; Stein, P. C.; Boye, H. A.","Hydrothermal synthesis and crystal structure of alpha-LiZnAsO4","Journal of Materials Chemistry","1998","8","","969","975","10.1039/a707130b","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000645","5.6881","","5.6821","","8.0566","","90","","90","","90","","260.39","","","","","","","","","","","","","3","P 21 21 21","","","","","","- Nb O3 Sr0.97 -","","","","","","Peng, N. H.; Irvine, J. T. S.; Fitzgerald, A. G.","Synthesis and crystal structure of the distorted perovskite Sr0.97NbO3 determined by high resolution powder neutron diffraction","Journal of Materials Chemistry","1998","8","","1033","1038","10.1039/a708290h","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000675","9.791","","8.848","","6.834","","90","","107.8","","90","","563.69","","","","","","","","","","","","","3","C 1 2/m 1","","","","","","- Cr O4 V -","","","","","","Touboul, M.; Melghit, K.","Synthesis by chimie-douce and properties of Chromium(III) Vanadates(V)","Journal of Materials Chemistry","1995","5","","147","150","10.1039/jm9950500147","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000676","8.277","","9.291","","7.527","","90","","109.26","","90","","546.44","","","","","","","","","","","","","3","?","","","","","","- Cr2 O13 V4 -","","","","","","Touboul, M.; Melghit, K.","Synthesis by chimie-douce and properties of Chromium(III) Vanadates(V)","Journal of Materials Chemistry","1995","5","","147","150","10.1039/jm9950500147","","","","","","","","","","","","","","","","","","","","","","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",""
"6000730","16.4972","","7.0673","","9.495","","90","","113.477","","90","","1015.39","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C7 H9 Al Br O5 P -","","","","","","Chaplais, G.; Le, Bideau J; Leclercq, D.; Mutin, H.; Vioux, A.","Novel aluminium phenyl, benzyl, and bromobenzylphosphonates: structural characterisation and hydration-dehydration reactions","Journal of Materials Chemistry","2000","10","","1593","1601","10.1039/b000103l","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000731","8.979","","6.2299","","8.103","","90","","90.05","","90","","453.27","","","","","","","","","","","","","5","P 1 2/n 1","","","","","","- C4 H2 Cs O9 Y -","","","","","","Bataille, T.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behaviour of the new layered oxalate Y(H2O)Cs(C2O4)(2) studied by powder X-ray diffraction","Journal of Materials Chemistry","2000","10","","1707","1711","10.1039/b001201g","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000751","11.9021","","11.9021","","8.3962","","90","","90","","90","","1189.41","","","","","","","","","","","","","4","I 4/m c m","","","","","","- Ba3 Cu3 O12 Sc4 -","","","","","","Gregory, D. H.; Mawdsley, P. R.; Barker, S. J.; Daniell, W.; Weston, D. P.","Synthesis, stoichiometry and structure of the quaternary scandium cuprate Ba3Cu3Sc4O12 and of 334-phase solid solution members Ba3Cu3Sc4-xInxO12 (0 <= x <= 4)","Journal of Materials Chemistry","2001","11","","806","814","10.1039/b008787o","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000762","11.99","","9.496","","8.339","","90","","90","","90","","949.45","","","","","","","","","","","","","4","P 21 21 21","","","","","","- Fe2 H3 O12 V3 -","","","","","","Poizot, P.; Laruelle, S.; Touboul, M.; Louer, M.; Louer, D.","Synthesis and crystal structure of a new hydrated iron(III) vanadate Fe2(H2O)[V2O7 .VO3(OH)]","Journal of Materials Chemistry","2000","10","","1841","1845","10.1039/b000448k","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000763","3.6287","","3.6287","","19.0921","","90","","90","","120","","217.72","","","","","","","","","","","","","2","R -3 m","","","","","","- Ca2 N -","","","","","","Gregory, D. H.; Bowman, A.; Baker, C. F.; Weston, D. P.","Dicalcium nitride, Ca2N - a 2D ""excess electron"" compound; synthetic routes and crystal chemistry","Journal of Materials Chemistry","2000","10","","1635","1641","10.1039/b001911i","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7200192","12.839","0.003","13.863","0.003","16.379","0.003","81.66","0.03","73.32","0.03","89.26","0.03","2761.8","1.1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H42 Cl2 Eu N5 O10 -","- C58 H38 Eu N5 O10 -","- C116 H76 Eu2 N10 O20 -","2","1","","Biju, Silvanose; Ambili Raj, D. B.; Reddy, M. L. P.; Jayasankar, C. K.; Cowley, Alan H.; Findlater, Michael","Dual emission from stoichiometrically mixed lanthanide complexes of 3-phenyl-4-benzoyl-5-isoxazolonate and 2,2′-bipyridine","Journal of Materials Chemistry","2009","19","10","1425","","10.1039/b809563a","","","0.71073","MoKα","","0.1052","0.071","","","0.1703","0.184","","","","","","1.108","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7200268","33.15","0.003","13.5383","0.0012","11.0627","0.001","90","","109.036","0.001","90","","4693.4","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H17 Br2 F9 -","- C23 H17 Br2 F9 -","- C184 H136 Br16 F72 -","8","1","","Zhang, Xiaojie; Bu, Laju; Qu, Yao; Wang, Lixiang; Geng, Yanhou; Wang, Fosong","Novel spiro-fluorenes from tandem radical addition for liquid crystalline monodisperse conjugated oligomers","Journal of Materials Chemistry","2009","19","3","399","","10.1039/b811830b","","","0.71073","MoKα","","0.0774","0.0457","","","0.1141","0.1303","","","","","","1.028","","","","has coordinates","180333","2020-10-21","18:00:00",""
"7200272","8.4966","0.001","16.6904","0.0019","21.628","0.003","90.657","0.002","91.134","0.002","90.768","0.002","3066","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H92 Ag3 N3 P6 S3 Se3 -","- C43 H92 Ag3 N3 P6 S3 Se3 -","- C86 H184 Ag6 N6 P12 S6 Se6 -","2","1","","Panneerselvam, Arunkumar; Nguyen, Chinh Q.; Malik, Mohammad A.; O'Brien, Paul; Raftery, James","The CVD of silver selenide films from dichalcogenophosphinato and imidodichalcogenodiphosphinatosilver(I) single-source precursors","Journal of Materials Chemistry","2009","19","3","419","","10.1039/b812074a","","","0.71073","MoKα","","0.0961","0.0685","","","0.1319","0.1454","","","","","","1.129","","","","has coordinates,has disorder","180333","2020-10-21","18:00:00",""
"7200273","11.1586","0.001","16.4882","0.0015","23.028","0.002","90","","101.646","0.002","90","","4149.6","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H56 Ag4 P4 S4 Se4 -","- C24 H56 Ag4 P4 S4 Se4 -","- C96 H224 Ag16 P16 S16 Se16 -","4","1","","Panneerselvam, Arunkumar; Nguyen, Chinh Q.; Malik, Mohammad A.; O'Brien, Paul; Raftery, James","The CVD of silver selenide films from dichalcogenophosphinato and imidodichalcogenodiphosphinatosilver(I) single-source precursors","Journal of Materials Chemistry","2009","19","3","419","","10.1039/b812074a","","","0.71073","MoKα","","0.069","0.0453","","","0.0871","0.0944","","","","","","1.032","","","","has coordinates,has disorder","180333","2020-10-21","18:00:00",""
"7200323","3.828325","0.000023","17.00643","0.00011","2.981444","0.00002","90","","90","","90","","194.11","0.002","","","","","","","","","","","","4","I m m m","-I 2 2","71","","","","- Cs0.16 Mg0.09 O Ti0.41 -","- Cs0.1603 Mg0.0875 O Ti0.4125 -","- Cs1.2824 Mg0.7 O8 Ti3.3 -","8","0.5","","Gao, Tao; Fjellvåg, Helmer; Norby, Poul","Protonic titanate derived from CsxTi2−x/2Mgx/2O4 (x = 0.7) with lepidocrocite-type layered structure","Journal of Materials Chemistry","2009","19","6","787","794","10.1039/b813147c","powder diffraction","x-ray","0.520193","","","","","","","","","0.05844","","1.87","","","","","","","has coordinates","180334","2020-10-21","18:00:00",""
"7200376","10.8702","0.0005","12.6588","0.0006","14.6884","0.001","109.028","0.003","99.41","0.003","111.268","0.002","1687.08","0.17","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H38 F6 S2 -","- C35 H38 F6 S2 -","- C70 H76 F12 S4 -","2","1","","Jeong, Yong-Chul; Park, Dae Gyu; Lee, In Su; Yang, Sung Ik; Ahn, Kwang-Hyun","Highly fluorescent photochromic diarylethene with an excellent fatigue property","Journal of Materials Chemistry","2009","19","1","97","","10.1039/b814040e","","","0.71073","MoKα","","0.1476","0.0876","","","0.2817","0.3405","","","","","","1.07","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200377","10.7844","0.0002","12.9936","0.0002","14.1194","0.0002","112.573","0.001","97.254","0.001","98.273","0.001","1771.92","0.05","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H38 F6 O4 S2 -","- C35 H38 F6 O4 S2 -","- C70 H76 F12 O8 S4 -","2","1","","Jeong, Yong-Chul; Park, Dae Gyu; Lee, In Su; Yang, Sung Ik; Ahn, Kwang-Hyun","Highly fluorescent photochromic diarylethene with an excellent fatigue property","Journal of Materials Chemistry","2009","19","1","97","","10.1039/b814040e","","","0.71073","MoKα","","0.1","0.078","","","0.2366","0.2601","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200397","24.1106","0.0015","13.6691","0.0009","13.1241","0.0008","90","","90.278","0.001","90","","4325.3","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H37 Cl3 N2 O2 Pt -","- C40 H37 Cl3 N2 O2 Pt -","- C160 H148 Cl12 N8 O8 Pt4 -","4","1","","Zhou, Gui-Jiang; Wang, Qi; Wong, Wai-Yeung; Ma, Dongge; Wang, Lixiang; Lin, Zhenyang","A versatile color tuning strategy for iridium(III) and platinum(II) electrophosphors by shifting the charge-transfer states with an electron-deficient core","Journal of Materials Chemistry","2009","19","13","1872","","10.1039/b814507e","","","0.71073","MoKα","","0.0648","0.0422","","","0.1168","0.1322","","","","","","1.07","","","","has coordinates","180334","2020-10-21","18:00:00",""
"7200398","9.7385","0.0005","11.2842","0.0005","31.6544","0.0015","90","","94.941","0.001","90","","3465.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H40 N2 O2 Pt -","- C41 H40 N2 O2 Pt -","- C164 H160 N8 O8 Pt4 -","4","1","","Zhou, Gui-Jiang; Wang, Qi; Wong, Wai-Yeung; Ma, Dongge; Wang, Lixiang; Lin, Zhenyang","A versatile color tuning strategy for iridium(III) and platinum(II) electrophosphors by shifting the charge-transfer states with an electron-deficient core","Journal of Materials Chemistry","2009","19","13","1872","","10.1039/b814507e","","","0.71073","MoKα","","0.0394","0.0307","","","0.071","0.0742","","","","","","1.082","","","","has coordinates","180334","2020-10-21","18:00:00",""
"7200399","8.1679","0.0005","26.7111","0.0015","10.9458","0.0006","90","","107.251","0.001","90","","2280.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H27 N O2 Pt -","- C27 H27 N O2 Pt -","- C108 H108 N4 O8 Pt4 -","4","1","","Zhou, Gui-Jiang; Wang, Qi; Wong, Wai-Yeung; Ma, Dongge; Wang, Lixiang; Lin, Zhenyang","A versatile color tuning strategy for iridium(III) and platinum(II) electrophosphors by shifting the charge-transfer states with an electron-deficient core","Journal of Materials Chemistry","2009","19","13","1872","","10.1039/b814507e","","","0.71073","MoKα","","0.0309","0.0272","","","0.0616","0.0628","","","","","","1.176","","","","has coordinates","180334","2020-10-21","18:00:00",""
"7200400","9.6884","0.0007","7.8986","0.0006","23.7456","0.0018","90","","95.083","0.001","90","","1810","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H17 N O3 Pt -","- C23 H17 N O3 Pt -","- C92 H68 N4 O12 Pt4 -","4","1","","Zhou, Gui-Jiang; Wang, Qi; Wong, Wai-Yeung; Ma, Dongge; Wang, Lixiang; Lin, Zhenyang","A versatile color tuning strategy for iridium(III) and platinum(II) electrophosphors by shifting the charge-transfer states with an electron-deficient core","Journal of Materials Chemistry","2009","19","13","1872","","10.1039/b814507e","","","0.71073","MoKα","","0.0304","0.0275","","","0.0681","0.0694","","","","","","1.082","","","","has coordinates","180335","2020-10-21","18:00:00",""
"7200401","12.2247","0.0018","13.728","0.002","13.838","0.002","63.248","0.002","74.128","0.002","74.473","0.003","1966.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H31 Cl4 Ir N2 O4 -","- C43 H31 Cl4 Ir N2 O4 -","- C86 H62 Cl8 Ir2 N4 O8 -","2","1","","Zhou, Gui-Jiang; Wang, Qi; Wong, Wai-Yeung; Ma, Dongge; Wang, Lixiang; Lin, Zhenyang","A versatile color tuning strategy for iridium(III) and platinum(II) electrophosphors by shifting the charge-transfer states with an electron-deficient core","Journal of Materials Chemistry","2009","19","13","1872","","10.1039/b814507e","","","0.71073","MoKα","","0.0498","0.043","","","0.1124","0.1176","","","","","","1.024","","","","has coordinates","180335","2020-10-21","18:00:00",""
"7200403","21.49","0.02","21.49","0.02","7.472","0.01","90","","90","","90","","3451","6","123.1","","","","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C88 H52 Cl4 Fe2 N16 P -","- C88 H52 Cl4 Fe2 N16 P -","- C176 H104 Cl8 Fe4 N32 P2 -","2","0.25","","Yu, Derrick Ethelbhert C.; Matsuda, Masaki; Tajima, Hiroyuki; Kikuchi, Akira; Taketsugu, Tetsuya; Hanasaki, Noriaki; Naito, Toshio; Inabe, Tamotsu","Variable magnetotransport properties in the TPP[Fe(Pc)L2]2 system (TPP = tetraphenylphosphonium, Pc = phthalocyaninato, L = CN, Cl, and Br)","Journal of Materials Chemistry","2009","19","6","718","","10.1039/b814609h","","","0.71075","MoKα","","","0.047","","","","0.1288","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200404","21.41","0.002","21.41","0.002","7.5777","0.0007","90","","90","","90","","3473.5","0.6","123.1","","","","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C88 H52 Br4 Fe2 N16 P -","- C88 H52 Br4 Fe2 N16 P -","- C176 H104 Br8 Fe4 N32 P2 -","2","0.25","","Yu, Derrick Ethelbhert C.; Matsuda, Masaki; Tajima, Hiroyuki; Kikuchi, Akira; Taketsugu, Tetsuya; Hanasaki, Noriaki; Naito, Toshio; Inabe, Tamotsu","Variable magnetotransport properties in the TPP[Fe(Pc)L2]2 system (TPP = tetraphenylphosphonium, Pc = phthalocyaninato, L = CN, Cl, and Br)","Journal of Materials Chemistry","2009","19","6","718","","10.1039/b814609h","","","0.71075","MoKα","","","0.0378","","","","0.1091","","","","","","1.007","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200405","10.501","0.006","12.232","0.006","12.938","0.006","85.71","0.03","68.16","0.04","66.19","0.04","1405.7","1.4","273.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C68 H46 Cl2 Fe N10 P -","- C68 H46 Cl2 Fe N9 P2 -","- C68 H46 Cl2 Fe N9 P2 -","1","0.5","","Yu, Derrick Ethelbhert C.; Matsuda, Masaki; Tajima, Hiroyuki; Kikuchi, Akira; Taketsugu, Tetsuya; Hanasaki, Noriaki; Naito, Toshio; Inabe, Tamotsu","Variable magnetotransport properties in the TPP[Fe(Pc)L2]2 system (TPP = tetraphenylphosphonium, Pc = phthalocyaninato, L = CN, Cl, and Br)","Journal of Materials Chemistry","2009","19","6","718","","10.1039/b814609h","","","0.71075","MoKα","","","0.0639","","","","0.138","","","","","","0.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200480","8.6874","0.0002","13.4536","0.0004","16.6938","0.0005","86.465","0.002","82.785","0.001","81.25","0.002","1911.34","0.09","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C54 H34 N4 -","- C54 H34 N4 -","- C108 H68 N8 -","2","1","","Kuo, Chun-Jung; Li, Ting-Yu; Lien, Chia-Chun; Liu, Charng-Hsing; Wu, Fang-Iy; Huang, Min-Jie","Bis(phenanthroimidazolyl)biphenyl derivatives as saturated blue emitters for electroluminescent devices","Journal of Materials Chemistry","2009","19","13","1865","","10.1039/b816327h","","","0.71073","MoKα","","0.1347","0.0673","","","0.137","0.19","","","","","","0.864","","","","has coordinates","180335","2020-10-21","18:00:00",""
"7200488","32.633","0.007","4.9552","0.001","11.018","0.002","90","","104.7","0.03","90","","1723.3","0.6","113","2","113","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H14 S2 -","- C24 H14 S2 -","- C96 H56 S8 -","4","0.5","","Meng, Qing; Gao, Jianhua; Li, Rongjin; Jiang, Lang; Wang, Chengliang; Zhao, Huaping; Liu, Caiming; Li, Hongxiang; Hu, Wenping","New type of organic semiconductors for field-effect transistors with carbon-carbon triple bonds","Journal of Materials Chemistry","2009","19","10","1477","","10.1039/b816590d","","","0.71073","MoKα","","0.0894","0.0821","","","0.1675","0.1716","","","","","","1.119","","","","has coordinates","180335","2020-10-21","18:00:00",""
"7200499","8.9462","0.0006","5.2818","0.0004","10.1259","0.0007","90","","93.297","0.002","90","","477.68","0.06","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H8 Co3 O10 S2 -","- C2 H8 Co3 O10 S2 -","- C4 H16 Co6 O20 S4 -","2","0.5","","Feller, Russell K.; Melot, Brent C.; Forster, Paul M.; Cheetham, Anthony K.","A hybrid cobalt disulfonate with a novel inorganic layer architecture exhibiting a field-induced magnetic transition","Journal of Materials Chemistry","2009","19","17","2604","","10.1039/b816815f","","","0.71073","MoKα","","0.0288","0.0268","","","0.0683","0.0697","","","","","","1.107","","","","has coordinates","180335","2020-10-21","18:00:00",""
"7200513","11.602","0.004","12.373","0.004","15.379","0.006","72.451","0.007","89.477","0.006","65.076","0.005","1891.1","1.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","kugpd30","","","- C37 H31 Cl5 O4 P2 Pd S2 -","- C37 H31 Cl5 O4 P2 Pd S2 -","- C74 H62 Cl10 O8 P4 Pd2 S4 -","2","1","","Velauthamurty, Kuhamoorthy; Higgins, Simon J.; Rajapakse, R. M. Gamini; Bacsa, John; van Zalinge, Harm; Nichols, Richard J.; Haiss, Wolfgang","Synthesis and characterization of monomeric and polymeric Pd(II) and Pt(II) complexes of 3,4-ethylenedioxythiophene-functionalized phosphine ligands","Journal of Materials Chemistry","2009","19","13","1850","","10.1039/b817210b","","","0.71073","MoKα","","0.1292","0.1087","","","0.2043","0.2138","","","","","","1.28","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200514","11.379","0.002","12.109","0.002","15.524","0.003","72.37","0.004","89.055","0.005","66.038","0.005","1848.9","0.6","100","","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H40 Cl2 O5 P2 Pt S2 -","- C36 H30 Cl2 O4 P2 Pt S2 -","- C72 H60 Cl4 O8 P4 Pt2 S4 -","2","1","","Velauthamurty, Kuhamoorthy; Higgins, Simon J.; Rajapakse, R. M. Gamini; Bacsa, John; van Zalinge, Harm; Nichols, Richard J.; Haiss, Wolfgang","Synthesis and characterization of monomeric and polymeric Pd(II) and Pt(II) complexes of 3,4-ethylenedioxythiophene-functionalized phosphine ligands","Journal of Materials Chemistry","2009","19","13","1850","","10.1039/b817210b","","","0.71073","MoKα","","0.0623","0.0403","","","0.0901","0.0955","","","","","","0.916","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200515","9.244","0.005","10.182","0.005","10.679","0.006","107.001","0.008","96.758","0.009","106.538","0.008","899","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H34 Cl2 O4 P2 Pd S2 -","- C38 H34 Cl2 O4 P2 Pd S2 -","- C38 H34 Cl2 O4 P2 Pd S2 -","1","0.5","","Velauthamurty, Kuhamoorthy; Higgins, Simon J.; Rajapakse, R. M. Gamini; Bacsa, John; van Zalinge, Harm; Nichols, Richard J.; Haiss, Wolfgang","Synthesis and characterization of monomeric and polymeric Pd(II) and Pt(II) complexes of 3,4-ethylenedioxythiophene-functionalized phosphine ligands","Journal of Materials Chemistry","2009","19","13","1850","","10.1039/b817210b","","","0.71073","MoKα","","0.0537","0.0417","","","0.1035","0.108","","","","","","0.984","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200517","9.751","0.0008","10.1889","0.0008","20.6391","0.0008","90","","90","","90","","2050.5","0.2","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 N O9 P2 Y -","- C4 H8 N O9 P2 Y -","- C32 H64 N8 O72 P16 Y8 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","9.2249","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200518","9.8645","0.0016","10.3423","0.0016","20.454","0.003","90","","90","","90","","2086.8","0.6","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 La N O9 P2 -","- C4 H8 La N O9 P2 -","- C32 H64 La8 N8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","9.1349","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200519","9.9654","0.0008","10.4467","0.0009","20.708","0.002","90","","90","","90","","2155.8","0.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 La N O9 P2 -","- C4 H8 La N O9 P2 -","- C32 H64 La8 N8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","","","0.71013","Synchrotron","","0.2022","0.1909","","","0.447","0.4537","","","","","","1.157","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200520","9.7951","0.0009","10.2777","0.0009","20.4047","0.0018","90","","90","","90","","2054.2","0.3","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 N O9 P2 Pr -","- C4 H8 N O9 P2 Pr -","- C32 H64 N8 O72 P16 Pr8 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","8.8946","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200521","9.7736","0.0014","10.2529","0.0015","20.4","0.003","90","","90","","90","","2044.2","0.5","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 N Nd O9 P2 -","- C4 H8 N Nd O9 P2 -","- C32 H64 N8 Nd8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","9.8831","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200522","9.8402","0.0007","10.3073","0.0008","20.6805","0.0013","90","","90","","90","","2097.5","0.3","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 N O9 P2 Sm -","- C4 H8 N O9 P2 Sm -","- C32 H64 N8 O72 P16 Sm8 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","8.9106","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200523","9.8328","0.001","10.2989","0.0011","20.6667","0.0012","90","","90","","90","","2092.9","0.3","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 Eu N O9 P2 -","- C4 H8 Eu N O9 P2 -","- C32 H64 Eu8 N8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","9.1133","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200524","9.8093","0.0007","10.2734","0.0008","20.6812","0.0011","90","","90","","90","","2084.1","0.2","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 Gd N O9 P2 -","- C4 H8 Gd N O9 P2 -","- C32 H64 Gd8 N8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","9.9385","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200525","9.6686","0.0017","10.1018","0.0018","20.359","0.004","90","","90","","90","","1988.5","0.6","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 N O9 P2 Tb -","- C4 H8 N O8.88 P2 Tb -","- C32 H64 N8 O71.04 P16 Tb8 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","11.017","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200526","9.7725","0.001","10.2143","0.0011","20.66","0.0018","90","","90","","90","","2062.3","0.4","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 Dy N O9 P2 -","- C4 H8 Dy N O9 P2 -","- C32 H64 Dy8 N8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","10.1911","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200527","9.7409","0.0006","10.1812","0.0006","20.6262","0.0013","90","","90","","90","","2045.6","0.2","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 Ho N O9 P2 -","- C4 H8 Ho N O9 P2 -","- C32 H64 Ho8 N8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","11.9288","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200528","9.6224","0.0014","10.0504","0.0015","20.334","0.003","90","","90","","90","","1966.5","0.5","298","","298","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H10 Er N O9 P2 -","- C4 H8 Er N O9 P2 -","- C32 H64 Er8 N8 O72 P16 -","8","1","","Cunha-Silva, Luís; Lima, Sérgio; Ananias, Duarte; Silva, Patrícia; Mafra, Luís; Carlos, Luís D.; Pillinger, Martyn; Valente, Anabela A.; Almeida Paz, Filipe A.; Rocha, João","Multi-functional rare-earth hybrid layered networks: photoluminescence and catalysis studies","Journal of Materials Chemistry","2009","19","17","2618","","10.1039/b817381h","powder diffraction","","","X-ray","","","","","","","","","10.352","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200585","16.8241","0.0006","17.0411","0.0009","16.1283","0.0007","90","","90","","90","","4624","0.4","90","0.2","90","0.2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C55 H64 N Si2 -","- C57 H62 N Si2 -","- C228 H248 N4 Si8 -","4","0.5","","Lim, Yee-Fun; Shu, Ying; Parkin, Sean R.; Anthony, John E.; Malliaras, George G.","Soluble n-type pentacene derivatives as novel acceptors for organic solar cells","Journal of Materials Chemistry","2009","19","19","3049","","10.1039/b818693f","","","1.54178","CuKα","","0.1779","0.1142","","","0.2931","0.3801","","","","","","1.012","","","","has coordinates,has disorder","180336","2020-10-21","18:00:00",""
"7200586","16.559","0.0001","17.614","0.0001","16.578","0.0002","90","0.0004","90","0.0003","90","0.0004","4835.31","0.07","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","?","- C432 N16 Si8 -","- C432 N16 Si8 -","","","","Lim, Yee-Fun; Shu, Ying; Parkin, Sean R.; Anthony, John E.; Malliaras, George G.","Soluble n-type pentacene derivatives as novel acceptors for organic solar cells","Journal of Materials Chemistry","2009","19","19","3049","","10.1039/b818693f","","","","","","","","","","","","","","","","","","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200587","16.6409","0.0006","17.5827","0.0007","18.8903","0.0008","90","","90","","90","","5527.1","0.4","90","0.2","90","0.2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C64 H74 N2 Si2 -","- C64 H74 N2 Si2 -","- C256 H296 N8 Si8 -","4","0.5","","Lim, Yee-Fun; Shu, Ying; Parkin, Sean R.; Anthony, John E.; Malliaras, George G.","Soluble n-type pentacene derivatives as novel acceptors for organic solar cells","Journal of Materials Chemistry","2009","19","19","3049","","10.1039/b818693f","","","0.71073","MoKα","","0.1571","0.0891","","","0.1833","0.2075","","","","","","1.095","","","","has coordinates,has disorder","180336","2020-10-21","18:00:00",""
"7200588","15.445","0.001","8.7029","0.0006","34.257","0.002","90","","97.428","0.003","90","","4566.1","0.5","90","0.2","90","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C50 H64 N2 Si2 -","- C52 H62 N2 Si2 -","- C208 H248 N8 Si8 -","4","1","","Lim, Yee-Fun; Shu, Ying; Parkin, Sean R.; Anthony, John E.; Malliaras, George G.","Soluble n-type pentacene derivatives as novel acceptors for organic solar cells","Journal of Materials Chemistry","2009","19","19","3049","","10.1039/b818693f","","","1.54178","CuKα","","0.1842","0.1793","","","0.3862","0.3887","","","","","","1.175","","","","has coordinates,has disorder","180336","2020-10-21","18:00:00",""
"7200607","8.963","0.001","27.576","0.001","9.207","0.001","90","","105.04","0.003","90","","2197.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","hexasilver diauranyl diarsenato tetraarsenate","","- Ag6 As6 O24 U2 -","- Ag6 As6 O24 U2 -","- Ag24 As24 O96 U8 -","4","1","","Alekseev, Evgeny V.; Krivovichev, Sergey V.; Depmeier, Wulf","Novel layered uranyl arsenates, Ag6[(UO2)2(As2O7)(As4O13)] and AI6[(UO2)2(AsO4)2(As2O7)] (AI–Ag and Na): first observation of a linear As4O136− anion and structure type evolution","Journal of Materials Chemistry","2009","19","17","2583","","10.1039/b818757f","","","0.71073","MoKα","","0.0492","0.044","","","0.1153","0.1203","","","","","","1.128","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200608","11.218","0.003","11.729","0.003","14.146","0.004","108.69","0.08","91.94","0.07","97.63","0.06","1741.7","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","hexasilver diauranyl diortoarsenato diarsenate","","- Ag6 As4 O19 U2 -","- Ag6 As4 O19 U2 -","- Ag24 As16 O76 U8 -","4","2","","Alekseev, Evgeny V.; Krivovichev, Sergey V.; Depmeier, Wulf","Novel layered uranyl arsenates, Ag6[(UO2)2(As2O7)(As4O13)] and AI6[(UO2)2(AsO4)2(As2O7)] (AI–Ag and Na): first observation of a linear As4O136− anion and structure type evolution","Journal of Materials Chemistry","2009","19","17","2583","","10.1039/b818757f","","","0.71073","MoKα","","0.21","0.0669","","","0.1039","0.1365","","","","","","0.905","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200609","10.996","0.003","11.633","0.003","14.057","0.004","108.63","0.03","91.27","0.02","97.4","0.02","1685.9","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","hexsodium diauranyl diortoarsenato diarsenate","","- As4 Na6 O19 U2 -","- As4 Na6 O19 U2 -","- As16 Na24 O76 U8 -","4","2","","Alekseev, Evgeny V.; Krivovichev, Sergey V.; Depmeier, Wulf","Novel layered uranyl arsenates, Ag6[(UO2)2(As2O7)(As4O13)] and AI6[(UO2)2(AsO4)2(As2O7)] (AI–Ag and Na): first observation of a linear As4O136− anion and structure type evolution","Journal of Materials Chemistry","2009","19","17","2583","","10.1039/b818757f","","","0.71073","MoKα","","0.1327","0.0475","","","0.0755","0.0918","","","","","","0.926","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200616","5.4521","0.0003","6.147","0.0003","17.4832","0.0009","90","","90","","90","","585.93","0.05","100","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H2 N6 O2 -","- C3 H2 N6 O2 -","- C12 H8 N24 O8 -","4","1","","Klapötke, Thomas M.; Miró Sabaté, Carles; Rasp, Matthias","Synthesis and properties of 5-nitrotetrazole derivatives as new energetic materials","Journal of Materials Chemistry","2009","19","15","2240","","10.1039/b818925k","","x-ray","0.71073","MoKα","","0.0344","0.0255","","","0.0563","0.0622","","","","","","1.06","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200617","6.3238","0.0005","4.9208","0.0004","13.0318","0.0012","90","","101.132","0.009","90","","397.9","0.06","100","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C3 H5 N9 O3 -","- C3 H5 N9 O3 -","- C6 H10 N18 O6 -","2","1","","Klapötke, Thomas M.; Miró Sabaté, Carles; Rasp, Matthias","Synthesis and properties of 5-nitrotetrazole derivatives as new energetic materials","Journal of Materials Chemistry","2009","19","15","2240","","10.1039/b818925k","","x-ray","0.71073","MoKα","","0.0611","0.0343","","","0.0503","0.0589","","","","","","1.015","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200618","5.027","0.005","30.882","0.004","14.223","0.006","90","","92.413","0.005","90","","2206","2","100","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H9 N13 O2 -","- C4 H9 N13 O2 -","- C32 H72 N104 O16 -","8","2","","Klapötke, Thomas M.; Miró Sabaté, Carles; Rasp, Matthias","Synthesis and properties of 5-nitrotetrazole derivatives as new energetic materials","Journal of Materials Chemistry","2009","19","15","2240","","10.1039/b818925k","","x-ray","0.71073","MoKα","","0.1266","0.0423","","","0.0676","0.0984","","","","","","1.058","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200619","7.471","0.0004","7.8386","0.0005","18.0365","0.0011","84.318","0.005","78.597","0.005","69.203","0.006","967.47","0.11","100","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C3 H8 N10 O3 -","- C3 H8 N10 O3 -","- C12 H32 N40 O12 -","4","2","","Klapötke, Thomas M.; Miró Sabaté, Carles; Rasp, Matthias","Synthesis and properties of 5-nitrotetrazole derivatives as new energetic materials","Journal of Materials Chemistry","2009","19","15","2240","","10.1039/b818925k","","x-ray","0.71073","MoKα","","0.0572","0.0315","","","0.0719","0.0797","","","","","","0.945","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200642","32.458","0.004","7.1893","0.0009","11.7654","0.0017","90","","90","","90","","2745.5","0.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","(TAMS)Bi2Cl8","(TAMS)Bi2Cl8","","- C17 H22 Bi2 Cl8 N2 -","- C17 H22 Bi2 Cl8 N2 -","- C68 H88 Bi8 Cl32 N8 -","4","1","","Xu, Gang; Li, Yan; Zhou, Wei-Wei; Wang, Guo-Jian; Long, Xi-Fa; Cai, Li-Zhen; Wang, Ming-Sheng; Guo, Guo-Cong; Huang, Jin-Shun; Bator, Grazyna; Jakubas, Ryszard","A ferroelectric inorganic‒organic hybrid based on NLO-phore stilbazolium","Journal of Materials Chemistry","2009","19","15","2179","","10.1039/b819473d","","","0.71073","MoKα","","0.0674","0.0591","","","0.1487","0.1552","","","","","","1.076","","","","has coordinates","180337","2020-10-21","18:00:00",""
"7200643","7.9516","","6.5588","","27.0024","","90","","90","","90","","1408.26","","","","","","","","","","","","","5","P 1","P 1","1","","","","?","- C20 H20 Cl16 N20 Ti16 -","- C20 H20 Cl16 N20 Ti16 -","","","","Yamanaka, Shoji; Yasunaga, Toshihiro; Yamaguchi, Kosuke; Tagawa, Masahiro","Structure and superconductivity of the intercalation compounds of TiNCl with pyridine and alkali metals as intercalants","Journal of Materials Chemistry","2009","19","17","2573","","10.1039/b819541b","","","","","","","","","","","","","","","","","","","","","has coordinates","282882","2023-04-27","15:29:04",""
"7200684","8.9568","0.0003","9.8717","0.0003","17.9905","0.0005","102.51","0.002","92.343","0.002","100.403","0.002","1522.1","0.08","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C6 H27.5 B4 Fe2 N4.5 O30 P7 -","- C6 H20 B4 Fe2 N4.5 O30 P7 -","- C12 H40 B8 Fe4 N9 O60 P14 -","2","1","","Yang, Weiting; Li, Jiyang; Pan, Qinhe; Xing, Hongzhu; Chen, Yan; Yu, Jihong; Xu, Ruren","Synthesis, structure and magnetic property of a new organo-templated mixed-valent iron(ii, iii) borophosphate","Journal of Materials Chemistry","2009","19","26","4523","","10.1039/b820130g","","","0.71073","MoKα","","0.06","0.0434","","","0.1152","0.1224","","","","","","1.044","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7200685","5.94547","0.00008","3.59174","0.00005","6.79969","0.00011","90","","90","","90","","145.205","0.004","298","","298","","","","","","","","","2","P n m a","-P 2ac 2n","62","Calcium deuteride","","","- Ca D2 -","- Ca D1.913 -","- Ca4 D7.652 -","4","0.5","","Verbraeken, Maarten C.; Suard, Emmanuelle; Irvine, John T. S.","Structural and electrical properties of calcium and strontium hydrides","Journal of Materials Chemistry","2009","19","18","2766","","10.1039/b820173k","powder diffraction","neutron","1.90946","ConstantWavelengthNeutronDiffraction","","","","","","","","","4.7725","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200686","4.81072","0.00013","4.81072","0.00013","4.81072","0.00013","90","","90","","90","","111.335","0.005","298","","298","","","","","","","","","2","F m -3 m","-F 4 2 3","225","Calcium oxide","","","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Verbraeken, Maarten C.; Suard, Emmanuelle; Irvine, John T. S.","Structural and electrical properties of calcium and strontium hydrides","Journal of Materials Chemistry","2009","19","18","2766","","10.1039/b820173k","powder diffraction","neutron","1.90946","ConstantWavelengthNeutronDiffraction","","","","","","","","","3.9871","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200687","5.94558","0.0001","3.59194","0.00006","6.79917","0.00013","90","","90","","90","","145.204","0.004","298","","298","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca0.999 D1.82 Na0.001 -","- Ca D1.816 Na0.001 -","- Ca4 D7.264 Na0.004 -","4","0.5","","Verbraeken, Maarten C.; Suard, Emmanuelle; Irvine, John T. S.","Structural and electrical properties of calcium and strontium hydrides","Journal of Materials Chemistry","2009","19","18","2766","","10.1039/b820173k","powder diffraction","neutron","1.90946","ConstantWavelengthNeutronDiffraction","","","","","","","","","5.7414","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200688","6.3673","0.0001","3.86291","0.00006","7.30892","0.00012","90","","90","","90","","179.772","0.005","298","","298","","","","","","","","","2","P n m a","-P 2ac 2n","62","Strontium deuteride","","","- D2 Sr -","- D1.902 Sr -","- D7.608 Sr4 -","4","0.5","","Verbraeken, Maarten C.; Suard, Emmanuelle; Irvine, John T. S.","Structural and electrical properties of calcium and strontium hydrides","Journal of Materials Chemistry","2009","19","18","2766","","10.1039/b820173k","powder diffraction","neutron","1.90946","ConstantWavelengthNeutronDiffraction","","","","","","","","","6.5559","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200689","5.16132","0.00013","5.16132","0.00013","5.16132","0.00013","90","","90","","90","","137.494","0.006","298","","298","","","","","","","","","2","F m -3 m","-F 4 2 3","225","Strontium oxide","","","- O Sr -","- O Sr -","- O4 Sr4 -","4","0.0208333","","Verbraeken, Maarten C.; Suard, Emmanuelle; Irvine, John T. S.","Structural and electrical properties of calcium and strontium hydrides","Journal of Materials Chemistry","2009","19","18","2766","","10.1039/b820173k","powder diffraction","neutron","1.90946","ConstantWavelengthNeutronDiffraction","","","","","","","","","7.0397","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200690","6.36729","0.00009","3.86346","0.00006","7.30807","0.00011","90","","90","","90","","179.777","0.005","298","","298","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- D1.87 Na0.001 Sr0.999 -","- D1.868 Na0.001 Sr -","- D7.472 Na0.004 Sr4 -","4","0.5","","Verbraeken, Maarten C.; Suard, Emmanuelle; Irvine, John T. S.","Structural and electrical properties of calcium and strontium hydrides","Journal of Materials Chemistry","2009","19","18","2766","","10.1039/b820173k","powder diffraction","neutron","1.90946","ConstantWavelengthNeutronDiffraction","","","","","","","","","4.4178","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200695","14.389","0.006","18.111","0.008","15.87","0.007","90","","94.301","0.005","90","","4124","3","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H23 N5 O -","- C20 H23 N5 O -","- C160 H184 N40 O8 -","8","1","","Wang, Ruiyao; Pellerin, Christian; Lebel, Olivier","Role of hydrogen bonding in the formation of glasses by small molecules: a triazine case study","Journal of Materials Chemistry","2009","19","18","2747","","10.1039/b820294j","","","0.71073","MoKα","","0.1528","0.0792","","","0.2006","0.2581","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200696","8.4082","0.0006","15.0816","0.0011","16.0829","0.0012","100.491","0.001","100.368","0.001","106.073","0.001","1868.8","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H21 N3 O3 -","- C20 H21 N3 O3 -","- C80 H84 N12 O12 -","4","2","","Wang, Ruiyao; Pellerin, Christian; Lebel, Olivier","Role of hydrogen bonding in the formation of glasses by small molecules: a triazine case study","Journal of Materials Chemistry","2009","19","18","2747","","10.1039/b820294j","","","0.71073","MoKα","","0.0635","0.0401","","","0.1047","0.1198","","","","","","1.038","","","","has coordinates","180337","2020-10-21","18:00:00",""
"7200697","5.9733","0.0007","30.794","0.004","10.4696","0.0012","90","","96.178","0.002","90","","1914.6","0.4","180","2","180","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C20 H20 Cl N5.5 -","- C20 Cl N5.5 -","- C80 Cl4 N22 -","4","1","","Wang, Ruiyao; Pellerin, Christian; Lebel, Olivier","Role of hydrogen bonding in the formation of glasses by small molecules: a triazine case study","Journal of Materials Chemistry","2009","19","18","2747","","10.1039/b820294j","","","0.71073","MoKα","","0.0998","0.0808","","","0.2254","0.2403","","","","","","1.1","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7200752","12.3962","0.0019","14.12","0.002","13.92","0.002","90","","114.759","0.004","90","","2212.5","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 Cl2 N O6 -","- C21 H21 Cl2 N O6 -","- C84 H84 Cl8 N4 O24 -","4","1","","Hwu, Jih Ru; Hsu, Yung Chang; Josephrajan, Thainashmuthu; Tsay, Shwu-Chen","Fine tuning of blue photoluminescence from indoles for device fabrication","Journal of Materials Chemistry","2009","19","19","3084","","10.1039/b821246e","","","0.71073","MoKα","","0.0991","0.0704","","","0.2158","0.2365","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200761","13.30701","","23.74339","","7.91702","","90","","90.0001","","89.9999","","2501.41","","","","","","","","","","","","","2","P 1","P 1","1","","","","?","- C96 N128 -","- C96 N128 -","","","","Gracia, J.; Kroll, P.","Corrugated layered heptazine-based carbon nitride: the lowest energy modifications of C3N4 ground state","Journal of Materials Chemistry","2009","19","19","3013","","10.1039/b821568e","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180338","2020-10-21","18:00:00",""
"7200798","7.6113","","15.303268","","50","","90","","90","","90.2618","","5823.83","","","","","","","","","","","","","4","P 1","P 1","1","","","","?","- H44 Na4 O88 Si32 -","- H44 Na4 O88 Si32 -","","","","Iozzi, Maria Francesca; Bisio, Chiara; Regi-Macedo, Thais; Airoldi, Claudio; Cossi, Maurizio; Marchese, Leonardo","Structural changes induced by dehydration in the crystalline layered silicate Na-RUB-18: a computational/experimental combined study","Journal of Materials Chemistry","2009","19","17","2610","","10.1039/b822013c","","","","","","","","","","","","","","","","","","","","","has coordinates","180338","2020-10-21","18:00:00",""
"7200799","7.62564","","15.381577","","50","","90","","90","","90.1302","","5864.7","","","","","","","","","","","","","4","P 1","P 1","1","","","","?","- H28 Na4 O80 Si32 -","- H28 Na4 O80 Si32 -","","","","Iozzi, Maria Francesca; Bisio, Chiara; Regi-Macedo, Thais; Airoldi, Claudio; Cossi, Maurizio; Marchese, Leonardo","Structural changes induced by dehydration in the crystalline layered silicate Na-RUB-18: a computational/experimental combined study","Journal of Materials Chemistry","2009","19","17","2610","","10.1039/b822013c","","","","","","","","","","","","","","","","","","","","","has coordinates","180338","2020-10-21","18:00:00",""
"7200829","7.7818","0.0004","4.9567","0.0003","34.4265","0.0016","90","","91.993","0.003","90","","1327.1","0.12","150","","150","","","","","","","","Synthesized by the authors. See text","4","P 1 21 1","P 2yb","4","","","","- C28 H47 N O3 -","- C28 H47 N O3 -","- C56 H94 N2 O6 -","2","1","","Bastiat, Guillaume; Leroux, Jean-Christophe","Pharmaceutical organogels prepared from aromatic amino acid derivatives","Journal of Materials Chemistry","2009","19","23","3867","","10.1039/b822657a","","","1.54178","CuKα","","0.0832","0.0502","","","0.1126","0.1216","","","","","","1.173","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200830","7.7987","0.0003","4.9374","0.0002","34.757","0.0014","90","","93.642","0.002","90","","1335.63","0.09","150","","150","","","","","","","","Synthesized by the authors. See text","4","P 1 21 1","P 2yb","4","","","","- C28 H47 N O4 -","- C28 H47 N O4 -","- C56 H94 N2 O8 -","2","1","","Bastiat, Guillaume; Leroux, Jean-Christophe","Pharmaceutical organogels prepared from aromatic amino acid derivatives","Journal of Materials Chemistry","2009","19","23","3867","","10.1039/b822657a","","","1.54178","CuKα","","0.0395","0.0369","","","0.0999","0.1016","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200847","11.8333","0.0009","5.1318","0.0003","40.565","0.004","90","","93.54","0.01","90","","2458.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","EDT-TTF-CONH-Bypiridine-NH2","","","- C20 H16 Cl2 N4 O S6 -","- C20 H16 Cl2 N4 O S6 -","- C80 H64 Cl8 N16 O4 S24 -","4","1","","Danila, Ion; Riobé, François; Puigmartí-Luis, Josep; Pérez del Pino, Ángel; Wallis, John D.; Amabilino, David B.; Avarvari, Narcis","Supramolecular electroactive organogel and conducting nanofibers with C3-symmetrical architectures","Journal of Materials Chemistry","2009","19","26","4495","","10.1039/b822884a","","","0.71073","MoKα","","0.081","0.0652","","","0.1889","0.1992","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200859","8.7321","0.0003","14.2816","0.0004","16.6582","0.0005","90","","90","","90","","2077.42","0.11","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P b c a","-P 2ac 2ab","61","","","","- C8 H8 Br2 O2 S -","- C8 H8 Br2 O2 S -","- C64 H64 Br16 O16 S8 -","8","1","","Lepeltier, Marc; Hiltz, Jonathan; Lockwood, Tobias; Bélanger-Gariépy, Francine; Perepichka, Dmitrii F.","Towards crystal engineering of solid-state polymerization in dibromothiophenes","Journal of Materials Chemistry","2009","19","29","5167","","10.1039/b822997j","","","1.54178","CuKα","","0.0234","0.0226","","","0.0628","0.0638","","","","","","1.186","","","","has coordinates","180339","2020-10-21","18:00:00",""
"7200860","7.3511","0.0002","12.1366","0.0004","21.9075","0.0007","90","","90","","90","","1954.53","0.1","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P b c a","-P 2ac 2ab","61","","","","- C8 H6 Br2 O3 S -","- C8 H6 Br2 O3 S -","- C64 H48 Br16 O24 S8 -","8","1","","Lepeltier, Marc; Hiltz, Jonathan; Lockwood, Tobias; Bélanger-Gariépy, Francine; Perepichka, Dmitrii F.","Towards crystal engineering of solid-state polymerization in dibromothiophenes","Journal of Materials Chemistry","2009","19","29","5167","","10.1039/b822997j","","","1.54178","CuKα","","0.0485","0.0471","","","0.163","0.1644","","","","","","1.182","","","","has coordinates","180339","2020-10-21","18:00:00",""
"7200861","9.3142","0.0003","11.3466","0.0004","19.4858","0.0007","90","","90","","90","","2059.35","0.12","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P b c a","-P 2ac 2ab","61","","","","- C8 H6 Br2 O2 S2 -","- C8 H6 Br2 O2 S2 -","- C64 H48 Br16 O16 S16 -","8","1","","Lepeltier, Marc; Hiltz, Jonathan; Lockwood, Tobias; Bélanger-Gariépy, Francine; Perepichka, Dmitrii F.","Towards crystal engineering of solid-state polymerization in dibromothiophenes","Journal of Materials Chemistry","2009","19","29","5167","","10.1039/b822997j","","","1.54178","CuKα","","0.0505","0.0492","","","0.1409","0.1418","","","","","","1.229","","","","has coordinates","180339","2020-10-21","18:00:00",""
"7200874","11.0626","0.0002","12.0807","0.0003","16.4661","0.0004","90","","90","","90","","2200.59","0.09","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H36 Cu N2 O4 -","- C23 H36 Cu N2 O4 -","- C92 H144 Cu4 N8 O16 -","4","1","","Jana, Satyasankar; Cormack, Peter A. G.; Kennedy, Alan R.; Sherrington, David C.","Synthesis of main chain chiral methacrylate copolymers via chirality transfer from polymerizable chiral metal complexes","Journal of Materials Chemistry","2009","19","21","3427","","10.1039/b823205a","","","0.71073","MoKα","","0.0625","0.0377","","","0.0684","0.0747","","","","","","1.034","","","","has coordinates","180339","2020-10-21","18:00:00",""
"7200875","9.5553","0.0002","9.6147","0.0002","11.1816","0.0003","104.235","0.001","107.076","0.001","96.8","0.001","931.47","0.04","123","2","123","2","","","","","","","","5","P 1","P 1","1","","","","- C36 H48 Cu2 N4 O8 -","- C36 H48 Cu2 N4 O8 -","- C36 H48 Cu2 N4 O8 -","1","1","","Jana, Satyasankar; Cormack, Peter A. G.; Kennedy, Alan R.; Sherrington, David C.","Synthesis of main chain chiral methacrylate copolymers via chirality transfer from polymerizable chiral metal complexes","Journal of Materials Chemistry","2009","19","21","3427","","10.1039/b823205a","","","0.71073","MoKα","","0.0521","0.0361","","","0.0688","0.0747","","","","","","1.027","","","","has coordinates","180339","2020-10-21","18:00:00",""
"7200876","8.617","0.0002","12.0528","0.0003","13.793","0.0003","90","","90.446","0.001","90","","1432.48","0.06","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C33 H40 N2 O4 Zn -","- C33 H40 N2 O4 Zn -","- C66 H80 N4 O8 Zn2 -","2","1","","Jana, Satyasankar; Cormack, Peter A. G.; Kennedy, Alan R.; Sherrington, David C.","Synthesis of main chain chiral methacrylate copolymers via chirality transfer from polymerizable chiral metal complexes","Journal of Materials Chemistry","2009","19","21","3427","","10.1039/b823205a","","","0.71073","MoKα","","0.0334","0.0297","","","0.0646","0.0663","","","","","","1.044","","","","has coordinates,has disorder","180339","2020-10-21","18:00:00",""
"7200877","18.5904","0.0006","8.5393","0.0003","22.3795","0.0006","90","","106.848","0.002","90","","3400.23","0.19","120","2","120","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C13 H24 N2 O5 Zn -","- C13 H24 N2 O5 Zn -","- C104 H192 N16 O40 Zn8 -","8","2","","Jana, Satyasankar; Cormack, Peter A. G.; Kennedy, Alan R.; Sherrington, David C.","Synthesis of main chain chiral methacrylate copolymers via chirality transfer from polymerizable chiral metal complexes","Journal of Materials Chemistry","2009","19","21","3427","","10.1039/b823205a","","","0.71073","MoKα","","0.0794","0.0493","","","0.0876","0.1008","","","","","","1.036","","","","has coordinates,has disorder","180339","2020-10-21","18:00:00",""
"7200878","14.1674","0.0002","11.491","0.0002","14.8774","0.0003","90","","113.205","0.001","90","","2226.07","0.07","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H36 N2 O4 Zn -","- C23 H36 N2 O4 Zn -","- C92 H144 N8 O16 Zn4 -","4","2","","Jana, Satyasankar; Cormack, Peter A. G.; Kennedy, Alan R.; Sherrington, David C.","Synthesis of main chain chiral methacrylate copolymers via chirality transfer from polymerizable chiral metal complexes","Journal of Materials Chemistry","2009","19","21","3427","","10.1039/b823205a","","","0.71073","MoKα","","0.0693","0.0475","","","0.0951","0.1044","","","","","","1.035","","","","has coordinates","180339","2020-10-21","18:00:00",""
"7200879","7.7634","0.0006","10.9958","0.0009","24.578","0.002","90","","90","","90","","2098.1","0.3","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 N2 O4 Zn -","- C21 H32 N2 O4 Zn -","- C84 H128 N8 O16 Zn4 -","4","1","","Jana, Satyasankar; Cormack, Peter A. G.; Kennedy, Alan R.; Sherrington, David C.","Synthesis of main chain chiral methacrylate copolymers via chirality transfer from polymerizable chiral metal complexes","Journal of Materials Chemistry","2009","19","21","3427","","10.1039/b823205a","","","0.71073","MoKα","","0.0675","0.0428","","","0.0748","0.0831","","","","","","1.085","","","","has coordinates","180339","2020-10-21","18:00:00",""
"7200911","7.5213","0.0004","9.2047","0.0005","17.545","0.0008","100.384","0.0014","95.2384","0.0012","108.584","0.0016","1117.96","0.1","296.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H10 Cl4 Fe O2 S7 -","- C14 H10 Cl4 Fe O2 S7 -","- C28 H20 Cl8 Fe2 O4 S14 -","2","1","","Shao, Xiangfeng; Yamaji, Yuhta; Sugimoto, Toyonari","Antiferromagnetic ordering of the FeBr4− d-spins via strong π‒d interaction in a semiconducting EDT-CP-TTFVS·FeBr4 salt","Journal of Materials Chemistry","2009","19","22","3688","","10.1039/b900644c","","","0.71075","MoKα","","","0.0329","","","","0.0381","","","","","","1.095","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200912","7.614","0.0015","9.4388","0.0018","17.891","0.004","101.101","0.004","95.706","0.004","107.744","0.004","1184.4","0.4","298.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H10 Br4 Fe O2 S7 -","- C14 H10 Br4 Fe O2 S7 -","- C28 H20 Br8 Fe2 O4 S14 -","2","1","","Shao, Xiangfeng; Yamaji, Yuhta; Sugimoto, Toyonari","Antiferromagnetic ordering of the FeBr4− d-spins via strong π‒d interaction in a semiconducting EDT-CP-TTFVS·FeBr4 salt","Journal of Materials Chemistry","2009","19","22","3688","","10.1039/b900644c","","","0.71075","MoKα","","","0.0561","","","","0.0676","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200913","7.8147","0.0009","8.7364","0.0008","19.3695","0.0015","97.651","0.002","99.32","0.003","111.723","0.003","1185.1","0.2","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 Cl4 Fe S9 -","- C14 H10 Cl4 Fe S9 -","- C28 H20 Cl8 Fe2 S18 -","2","1","","Shao, Xiangfeng; Yamaji, Yuhta; Sugimoto, Toyonari","Antiferromagnetic ordering of the FeBr4− d-spins via strong π‒d interaction in a semiconducting EDT-CP-TTFVS·FeBr4 salt","Journal of Materials Chemistry","2009","19","22","3688","","10.1039/b900644c","","","0.71075","MoKα","","","0.046","","","","0.0524","","","","","","1.113","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200914","7.8986","0.0006","8.9341","0.0007","19.626","0.0014","97.549","0.002","99.3134","0.0018","111.839","0.002","1240.55","0.16","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 Br4 Fe S9 -","- C14 H10 Br4 Fe S9 -","- C28 H20 Br8 Fe2 S18 -","2","1","","Shao, Xiangfeng; Yamaji, Yuhta; Sugimoto, Toyonari","Antiferromagnetic ordering of the FeBr4− d-spins via strong π‒d interaction in a semiconducting EDT-CP-TTFVS·FeBr4 salt","Journal of Materials Chemistry","2009","19","22","3688","","10.1039/b900644c","","","0.71075","MoKα","","","0.0631","","","","0.0758","","","","","","1.104","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200916","12.7209","0.0017","14.6283","0.0019","16.413","0.002","90.34","0.002","90.874","0.003","100.198","0.002","3005.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H68.9 Cl O20.45 Ru2 -","- C52 H68 Cl O20.45 Ru2 -","- C104 H136 Cl2 O40.9 Ru4 -","2","1","","Chaia, Zulema D.; Rusjan, Marcia C.; Castro, Maria Ana; Donnio, Bertrand; Heinrich, Benoit; Guillon, Daniel; Baggio, Ricardo F.; Cukiernik, Fabio D.","Supramolecular architecture elucidation of the room temperature columnar mesophases exhibited by mixed-valent diruthenium alkoxybenzoates","Journal of Materials Chemistry","2009","19","28","4981","","10.1039/b900779b","","","0.71073","MoKα","","0.0907","0.0647","","","0.1398","0.1524","","","","","","1.041","","","","has coordinates","180340","2020-10-21","18:00:00",""
"7200919","10.137","0.005","10.228","0.005","12.747","0.007","74.562","0.008","83.796","0.009","60.952","0.007","1113.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H24 F8 N18 O14 Zn5 -","- C28 H16 F8 N18 O14 Zn5 -","- C28 H16 F8 N18 O14 Zn5 -","1","0.5","","Hulvey, Zeric; Falcao, Eduardo H. L.; Eckert, Juergen; Cheetham, Anthony K.","Enhanced H2 adsorption enthalpy in the low-surface area, partially fluorinated coordination polymer Zn5(triazole)6(tetrafluoroterephthalate)2(H2O)2·4H2O","Journal of Materials Chemistry","2009","19","25","4307","","10.1039/b900879a","","","0.71073","MoKα","","0.1102","0.0634","","","0.1515","0.1822","","","","","","1.025","","","","has coordinates","180340","2020-10-21","18:00:00",""
"7200922","12.318","0.003","3.8374","0.0009","16.385","0.004","90","","104.675","0.002","90","","749.2","0.3","293.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H10 F2 N2 O4 -","- C18 H10 F2 N2 O4 -","- C36 H20 F4 N4 O8 -","2","0.5","","Horiuchi, Sachio; Kumai, Reiji; Tokura, Yoshinori","Proton-displacive ferroelectricity in neutral cocrystals of anilic acids with phenazine","Journal of Materials Chemistry","2009","19","25","4421","","10.1039/b900987f","","","0.7107","MoKα","","","0.0388","","","","0.0525","","","","","","0.976","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200923","4.0812","0.0019","8.938","0.004","11.581","0.004","73.07","0.03","78.91","0.03","79.57","0.03","393.1","0.3","293.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H10 F2 N2 O4 -","- C18 H10 F2 N2 O4 -","- C18 H10 F2 N2 O4 -","1","0.5","","Horiuchi, Sachio; Kumai, Reiji; Tokura, Yoshinori","Proton-displacive ferroelectricity in neutral cocrystals of anilic acids with phenazine","Journal of Materials Chemistry","2009","19","25","4421","","10.1039/b900987f","","","0.7107","MoKα","","","0.0456","","","","0.073","","","","","","0.96","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200924","12.299","0.002","4.8114","0.0008","15.153","0.003","90","","107.604","0.0017","90","","854.7","0.3","293.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 Br2 N2 O4 -","- C18 H10 Br2 N2 O4 -","- C36 H20 Br4 N4 O8 -","2","0.5","","Horiuchi, Sachio; Kumai, Reiji; Tokura, Yoshinori","Proton-displacive ferroelectricity in neutral cocrystals of anilic acids with phenazine","Journal of Materials Chemistry","2009","19","25","4421","","10.1039/b900987f","","","0.7107","MoKα","","","0.0445","","","","0.0499","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200925","12.3","0.004","4.9829","0.0013","15.271","0.005","90","","106.939","0.006","90","","895.3","0.5","293.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 I2 N2 O4 -","- C18 H10 I2 N2 O4 -","- C36 H20 I4 N4 O8 -","2","0.5","","Horiuchi, Sachio; Kumai, Reiji; Tokura, Yoshinori","Proton-displacive ferroelectricity in neutral cocrystals of anilic acids with phenazine","Journal of Materials Chemistry","2009","19","25","4421","","10.1039/b900987f","","","0.7107","MoKα","","","0.0324","","","","0.0203","","","","","","1.815","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7200963","20.9958","0.0009","7.682","0.0003","22.6056","0.001","90","","113.585","0.001","90","","3341.5","0.2","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H33 Cl2 N3 O2 -","- C42 H33 Cl2 N3 O2 -","- C168 H132 Cl8 N12 O8 -","4","1","","Lin, Zhenghuan; Wen, Yuh-Sheng; Chow, Tahsin J.","White light-emitting devices with a single emitting layer based on bisindolylmaleimide fluorophores","Journal of Materials Chemistry","2009","19","29","5141","","10.1039/b901627a","","","0.71073","MoKα","","0.1066","0.0516","","","0.0944","0.1153","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200964","20.2844","0.0014","8.0018","0.0006","22.3701","0.0015","90","","100.289","0.003","90","","3572.5","0.4","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H28 Cl2 F5 N3 O2 -","- C42 H28 Cl2 F5 N3 O2 -","- C168 H112 Cl8 F20 N12 O8 -","4","1","","Lin, Zhenghuan; Wen, Yuh-Sheng; Chow, Tahsin J.","White light-emitting devices with a single emitting layer based on bisindolylmaleimide fluorophores","Journal of Materials Chemistry","2009","19","29","5141","","10.1039/b901627a","","","0.71073","MoKα","","0.1707","0.0659","","","0.1421","0.1841","","","","","","0.988","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200968","7.307","0.002","7.976","0.002","11.348","0.002","73.87","0.003","77.321","0.004","64.943","0.003","571.6","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H6 Br2 O2 -","- C14 H6 Br2 O2 -","- C28 H12 Br4 O4 -","2","1","","Gautrot, Julien E.; Hodge, Philip; Helliwell, Madeleine; Raftery, James; Cupertino, Domenico","Synthesis of electron-accepting polymers containing phenanthra-9,10-quinone units","Journal of Materials Chemistry","2009","19","24","4148","","10.1039/b901853k","","","0.71073","MoKα","","0.1561","0.0844","","","0.16","0.1846","","","","","","0.809","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200969","11.683","0.006","7.257","0.004","14.885","0.008","90","","109.542","0.008","90","","1189.3","1.1","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H6 Br2 O2 -","- C14 H6 Br2 O2 -","- C56 H24 Br8 O8 -","4","1","","Gautrot, Julien E.; Hodge, Philip; Helliwell, Madeleine; Raftery, James; Cupertino, Domenico","Synthesis of electron-accepting polymers containing phenanthra-9,10-quinone units","Journal of Materials Chemistry","2009","19","24","4148","","10.1039/b901853k","","","0.71073","MoKα","","0.0894","0.0532","","","0.0939","0.1042","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200981","4.8023","0.0002","9.3324","0.0003","12.6403","0.0004","70.868","0.002","80.91","0.002","77.056","0.002","519.41","0.03","293","2","293","2","","","","","","","","4","P 1","P 1","1","","","","- C21 H28 N2 O6 -","- C21 H28 N2 O6 -","- C21 H28 N2 O6 -","1","1","","Nagarajan, Subbiah; Mohan Das, Thangamuthu; Arjun, Pandian; Raaman, Nanjian","Design, synthesis and gelation studies of 4,6-O-butylidene-α,β-unsaturated-β-C-glycosidic ketones: application to plant tissue culture","Journal of Materials Chemistry","2009","19","26","4587","","10.1039/b902064k","","","0.71073","MoKα","","0.0526","0.043","","","0.116","0.1319","","","","","","1.098","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7200982","4.9409","0.0007","33.746","0.005","5.7154","0.0009","90","","101.967","0.009","90","","932.3","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H26 O7 -","- C20 H26 O7 -","- C40 H52 O14 -","2","1","","Nagarajan, Subbiah; Mohan Das, Thangamuthu; Arjun, Pandian; Raaman, Nanjian","Design, synthesis and gelation studies of 4,6-O-butylidene-α,β-unsaturated-β-C-glycosidic ketones: application to plant tissue culture","Journal of Materials Chemistry","2009","19","26","4587","","10.1039/b902064k","","","0.71073","MoKα","","0.0437","0.0376","","","0.0962","0.0997","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201000","12.5133","0.0003","34.5307","0.0008","8.9169","0.0002","90","","100.493","0.002","90","","3788.5","0.15","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H35 Cl2 N3 -","- C50 H35 Cl2 N3 -","- C200 H140 Cl8 N12 -","4","1","","Chi, Chih-Chin; Chiang, Chih-Long; Liu, Shun-Wei; Yueh, Han; Chen, Chin-Ti; Chen, Chao-Tsen","Achieving high-efficiency non-doped blue organic light-emitting diodes: charge-balance control of bipolar blue fluorescent materials with reduced hole-mobility","Journal of Materials Chemistry","2009","19","31","5561","","10.1039/b902910a","","","0.71073","MoKα","","0.0782","0.0392","","","0.0801","0.0851","","","","","","0.776","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201001","13.1622","0.0006","25.6042","0.0011","10.9596","0.0005","90","","107.046","0.002","90","","3531.2","0.3","150","0.1","150","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C49 H35 N3 -","- C49 H35 N3 -","- C196 H140 N12 -","4","1","","Chi, Chih-Chin; Chiang, Chih-Long; Liu, Shun-Wei; Yueh, Han; Chen, Chin-Ti; Chen, Chao-Tsen","Achieving high-efficiency non-doped blue organic light-emitting diodes: charge-balance control of bipolar blue fluorescent materials with reduced hole-mobility","Journal of Materials Chemistry","2009","19","31","5561","","10.1039/b902910a","","","0.71073","MoKα","","0.1094","0.0395","","","0.0735","0.0797","","","","","","0.685","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201004","15.495","0.0005","11.0758","0.0004","10.6108","0.0003","90","","102.392","0.001","90","","1778.59","0.1","298","2","571","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H18 O2 -","- C24 H18 O2 -","- C96 H72 O8 -","4","0.5","","Thomas, Reji; Varghese, Shinto; Kulkarni, G. U.","The influence of crystal packing on the solid state fluorescence behavior of alkyloxy substituted phenyleneethynylenes","Journal of Materials Chemistry","2009","19","25","4401","","10.1039/b902937k","","","0.71073","MoKα","","0.0395","0.0364","","","0.0914","0.094","","","","","","1.103","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201005","13.0543","0.0005","11.0691","0.0004","15.2735","0.0005","90","","109.434","0.002","90","","2081.27","0.13","571","2","571","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H22 O2 -","- C26 H22 O2 -","- C104 H88 O8 -","4","0.5","","Thomas, Reji; Varghese, Shinto; Kulkarni, G. U.","The influence of crystal packing on the solid state fluorescence behavior of alkyloxy substituted phenyleneethynylenes","Journal of Materials Chemistry","2009","19","25","4401","","10.1039/b902937k","","","0.71073","MoKα","","0.0787","0.0432","","","0.1097","0.1283","","","","","","1.026","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201006","5.7856","0.0001","14.9764","0.0004","13.3619","0.0003","90","","90.112","0.001","90","","1157.77","0.05","571","2","571","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 O2 -","- C28 H26 O2 -","- C56 H52 O4 -","2","0.5","","Thomas, Reji; Varghese, Shinto; Kulkarni, G. U.","The influence of crystal packing on the solid state fluorescence behavior of alkyloxy substituted phenyleneethynylenes","Journal of Materials Chemistry","2009","19","25","4401","","10.1039/b902937k","","","0.71073","MoKα","","0.0684","0.0424","","","0.112","0.1317","","","","","","1.016","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201007","6.2637","0.0002","21.4804","0.0006","9.259","0.0002","90","","93.187","0.001","90","","1243.84","0.06","571","2","571","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 O2 -","- C30 H30 O2 -","- C60 H60 O4 -","2","0.5","","Thomas, Reji; Varghese, Shinto; Kulkarni, G. U.","The influence of crystal packing on the solid state fluorescence behavior of alkyloxy substituted phenyleneethynylenes","Journal of Materials Chemistry","2009","19","25","4401","","10.1039/b902937k","","","0.71073","MoKα","","0.0563","0.0387","","","0.0985","0.1094","","","","","","1.026","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201008","6.2298","0.0002","22.1029","0.0006","10.0247","0.0003","90","","99.168","0.002","90","","1362.73","0.07","298","2","291","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 O2 -","- C32 H34 O2 -","- C64 H68 O4 -","2","0.5","","Thomas, Reji; Varghese, Shinto; Kulkarni, G. U.","The influence of crystal packing on the solid state fluorescence behavior of alkyloxy substituted phenyleneethynylenes","Journal of Materials Chemistry","2009","19","25","4401","","10.1039/b902937k","","","0.71073","MoKα","","0.0814","0.0515","","","0.1532","0.1878","","","","","","1.113","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201009","6.297","0.0002","22.7824","0.0008","10.6411","0.0002","90","","105.493","0.001","90","","1471.11","0.08","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C34 H38 O2 -","- C34 H38 O2 -","- C68 H76 O4 -","2","0.5","","Thomas, Reji; Varghese, Shinto; Kulkarni, G. U.","The influence of crystal packing on the solid state fluorescence behavior of alkyloxy substituted phenyleneethynylenes","Journal of Materials Chemistry","2009","19","25","4401","","10.1039/b902937k","","","0.71073","MoKα","","0.0608","0.0448","","","0.1151","0.1237","","","","","","0.952","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201010","5.8209","0.0004","10.0529","0.0008","24.9876","0.0019","90","","90","","90","","1462.2","0.19","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H10 O10 S2 Sc2 -","- C10 H10 O10 S2 Sc2 -","- C40 H40 O40 S8 Sc8 -","4","0.5","","Perles, Josefina; Snejko, Natalia; Iglesias, Marta; Monge, M. Ángeles","3D scandium and yttrium arenedisulfonate MOF materials as highly thermally stable bifunctional heterogeneous catalysts","Journal of Materials Chemistry","2009","19","36","6504","","10.1039/b902954k","","","0.71073","MoKα","","0.1051","0.0571","","","0.093","0.1035","","","","","","1.145","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201011","5.2459","0.0007","10.8963","0.0014","13.2466","0.0017","86.026","0.002","81.604","0.002","85.685","0.002","745.64","0.17","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H10 O10 S2 Sc2 -","- C10 H10 O10 S2 Sc2 -","- C20 H20 O20 S4 Sc4 -","2","1","","Perles, Josefina; Snejko, Natalia; Iglesias, Marta; Monge, M. Ángeles","3D scandium and yttrium arenedisulfonate MOF materials as highly thermally stable bifunctional heterogeneous catalysts","Journal of Materials Chemistry","2009","19","36","6504","","10.1039/b902954k","","","0.71073","MoKα","","0.1368","0.0995","","","0.2494","0.2926","","","","","","0.972","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201012","7.6693","0.0005","7.8627","0.0005","21.0191","0.0013","90","","91.607","0.001","90","","1266.98","0.14","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 O8 S2 Y -","- C10 H9 O8 S2 Y -","- C40 H36 O32 S8 Y4 -","4","1","","Perles, Josefina; Snejko, Natalia; Iglesias, Marta; Monge, M. Ángeles","3D scandium and yttrium arenedisulfonate MOF materials as highly thermally stable bifunctional heterogeneous catalysts","Journal of Materials Chemistry","2009","19","36","6504","","10.1039/b902954k","","","0.71073","MoKα","","0.0581","0.0341","","","0.0677","0.0717","","","","","","0.97","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201023","19.292","0.008","7.694","0.003","19.957","0.008","90","","117.454","0.007","90","","2628.7","1.8","291","2","291","2","","","","","","","see text","4","P 1 21 1","P 2yb","4","","(6-ammoniohexyl)ammonium bislithocholate","","- C54 H96 N2 O6 -","- C54 H96 N2 O6 -","- C108 H192 N4 O12 -","2","1","","Pal, Asish; Basit, Hajra; Sen, Saikat; Aswal, Vinod K.; Bhattacharya, Santanu","Structure and properties of two component hydrogels comprising lithocholic acid and organic amines","Journal of Materials Chemistry","2009","19","25","4325","","10.1039/b903407b","","","0.71073","MoKa","","0.1654","0.0666","","","0.1028","0.1325","","","","","","0.92","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201049","15.993","0.002","14.382","0.002","20.73","0.003","90","","114.568","0.004","90","","4336.5","1","298","1","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C26 H16 Cl4 Fe O4 S14 Se4 -","- C26 H16 Cl4 Fe O4 S14 Se4 -","- C104 H64 Cl16 Fe4 O16 S56 Se16 -","4","1","","Shao, Xiangfeng; Yamaji, Yuhta; Fujiwara, Hideki; Sugimoto, Toyonari","Interconvertible bistability in magnetic organic conductors based on bent donor molecules, EDO-EDSe-TTFVS(O)","Journal of Materials Chemistry","2009","19","32","5837","","10.1039/b904061g","","","0.71075","MoKα","","","0.0445","","","","0.0546","","","","","","1.078","","","","has coordinates","282882","2023-04-27","15:29:05",""
"7201050","15.961","0.0006","14.0875","0.0006","20.2992","0.0007","90","","113.437","0.001","90","","4187.7","0.3","150.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C26 H16 Cl4 Fe O4 S14 Se4 -","- C26 H16 Cl4 Fe O4 S14 Se4 -","- C104 H64 Cl16 Fe4 O16 S56 Se16 -","4","1","","Shao, Xiangfeng; Yamaji, Yuhta; Fujiwara, Hideki; Sugimoto, Toyonari","Interconvertible bistability in magnetic organic conductors based on bent donor molecules, EDO-EDSe-TTFVS(O)","Journal of Materials Chemistry","2009","19","32","5837","","10.1039/b904061g","","","0.71075","MoKα","","","0.0379","","","","0.0452","","","","","","1.062","","","","has coordinates","282882","2023-04-27","15:29:05",""
"7201051","16.0581","0.0012","14.4343","0.0011","20.866","0.0017","90","","114.688","0.0017","90","","4394.4","0.6","298.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C26 H16 Cl4 Ga O4 S14 Se4 -","- C26 H16 Cl4 Ga O4 S14 Se4 -","- C104 H64 Cl16 Ga4 O16 S56 Se16 -","4","1","","Shao, Xiangfeng; Yamaji, Yuhta; Fujiwara, Hideki; Sugimoto, Toyonari","Interconvertible bistability in magnetic organic conductors based on bent donor molecules, EDO-EDSe-TTFVS(O)","Journal of Materials Chemistry","2009","19","32","5837","","10.1039/b904061g","","","0.71075","MoKα","","","0.0724","","","","0.1036","","","","","","1.143","","","","has coordinates","282882","2023-04-27","15:29:05",""
"7201052","15.9774","0.001","14.1318","0.0009","20.3734","0.0012","90","","113.461","0.0014","90","","4219.8","0.5","150.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C26 H16 Cl4 Ga O4 S14 Se4 -","- C26 H16 Cl4 Ga O4 S14 Se4 -","- C104 H64 Cl16 Ga4 O16 S56 Se16 -","4","1","","Shao, Xiangfeng; Yamaji, Yuhta; Fujiwara, Hideki; Sugimoto, Toyonari","Interconvertible bistability in magnetic organic conductors based on bent donor molecules, EDO-EDSe-TTFVS(O)","Journal of Materials Chemistry","2009","19","32","5837","","10.1039/b904061g","","","0.71075","MoKα","","","0.0416","","","","0.05","","","","","","1.076","","","","has coordinates","282882","2023-04-27","15:29:05",""
"7201053","33.833","0.005","6.7777","0.001","41.27","0.007","90","","99.169","0.004","90","","9343","3","296.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H20 Cl6 Fe O6 S12 Se4 -","- C28 H20 Cl6 Fe O6 S12 Se4 -","- C224 H160 Cl48 Fe8 O48 S96 Se32 -","8","1","","Shao, Xiangfeng; Yamaji, Yuhta; Fujiwara, Hideki; Sugimoto, Toyonari","Interconvertible bistability in magnetic organic conductors based on bent donor molecules, EDO-EDSe-TTFVS(O)","Journal of Materials Chemistry","2009","19","32","5837","","10.1039/b904061g","","","0.71075","MoKα","","","0.0966","","","","0.122","","","","","","1.062","","","","has coordinates","282882","2023-04-27","15:29:05",""
"7201060","8.9342","0.0018","8.968","0.0018","9.2495","0.0018","90","","116.74","0.03","90","","661.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Cr2 O16 P4 Pb3 -","- Cr2 O16 P4 Pb3 -","- Cr4 O32 P8 Pb6 -","2","0.5","","Mao, Shaoyu; Mao, Yanping; Batchelor, Raymond J.; Guo, Haiyan; Ye, Zuo-Guang; Xie, Zhaoxiong; Zheng, Lansun","Polymorphic structures and properties of lead chromium phosphate Pb3Cr2(PO4)4","Journal of Materials Chemistry","2009","19","33","6034","","10.1039/b904277f","","","0.71073","MoKα","","0.0679","0.0595","","","0.1713","0.1745","","","","","","1.441","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201061","8.9455","0.0013","8.9455","0.0013","16.51","0.003","90","","90","","90","","1321.2","0.4","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- Cr2 O16 P4 Pb3 -","- Cr2 O16 P4 Pb3 -","- Cr8 O64 P16 Pb12 -","4","0.5","","Mao, Shaoyu; Mao, Yanping; Batchelor, Raymond J.; Guo, Haiyan; Ye, Zuo-Guang; Xie, Zhaoxiong; Zheng, Lansun","Polymorphic structures and properties of lead chromium phosphate Pb3Cr2(PO4)4","Journal of Materials Chemistry","2009","19","33","6034","","10.1039/b904277f","","","0.71073","MoKα","","0.0808","0.0713","","","0.1968","0.2021","","","","","","1.11","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201066","13.199","0.003","13.809","0.0019","20.867","0.004","93.792","0.01","99.24","0.009","103.551","0.011","3628.1","1.2","153","2","153","2","","","","","","","synthesis as described","3","P -1","-P 1","2","","FeC60C6H4nBu5Cp","","- C115 H70 Fe -","- C115 H70 Fe -","- C230 H140 Fe2 -","2","1","","Niinomi, Takaaki; Matsuo, Yutaka; Hashiguchi, Masahiko; Sato, Yoshiharu; Nakamura, Eiichi","Penta(organo)[60]fullerenes as acceptors for organic photovoltaic cells","Journal of Materials Chemistry","2009","19","32","5804","","10.1039/b904485j","","x-ray","0.71073","MoKα","","0.1156","0.081","","","0.2025","0.2359","","","","","","1.024","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201122","11.2511","0.0007","12.4067","0.001","17.7933","0.0012","96.813","0.004","91.644","0.005","116.369","0.006","2200.3","0.3","100","2","100","2","","","","","","","synthesis as described","3","P -1","-P 1","2","","","","- C52 H68 N4 -","- C52 H68 N4 -","- C104 H136 N8 -","2","1","","Zeitouny, Joceline; Aurisicchio, Claudia; Bonifazi, Davide; De Zorzi, Rita; Geremia, Silvano; Bonini, Massimo; Palma, Carlos-Andres; Samorì, Paolo; Listorti, Andrea; Belbakra, Abdelhalim; Armaroli, Nicola","Photoinduced structural modifications in multicomponent architectures containing azobenzene moieties as photoswitchable cores","Journal of Materials Chemistry","2009","19","27","4715","","10.1039/b905287a","","x-ray","1.5418","CuKα","","0.0668","0.0469","","","0.1045","0.1105","","","","","","0.971","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201124","22.803","0.005","5.9919","0.0012","26.097","0.005","90","","101.27","0.03","90","","3497","1.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N3 O11 Tb -","- C36 H30 N3 O11 Tb -","- C144 H120 N12 O44 Tb4 -","4","1","","Biju, Silvanose; Reddy, M. L. P.; Cowley, Alan H.; Vasudevan, Kalyan V.","3-Phenyl-4-acyl-5-isoxazolonate complex of Tb3+ doped into poly-β-hydroxybutyrate matrix as a promising light-conversion molecular device","Journal of Materials Chemistry","2009","19","29","5179","","10.1039/b905304b","","","0.71073","MoKα","","0.0886","0.0466","","","0.0999","0.1282","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7201125","16.244","0.005","8.813","0.005","16.888","0.005","90","","90","","90","","2417.7","1.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C104 H104 N8 O24 -","8","1","","Biju, Silvanose; Reddy, M. L. P.; Cowley, Alan H.; Vasudevan, Kalyan V.","3-Phenyl-4-acyl-5-isoxazolonate complex of Tb3+ doped into poly-β-hydroxybutyrate matrix as a promising light-conversion molecular device","Journal of Materials Chemistry","2009","19","29","5179","","10.1039/b905304b","","","0.71073","MoKα","","0.0864","0.0427","","","0.1112","0.1269","","","","","","0.965","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201126","8.756","0.001","38.268","0.003","12.162","0.002","90","","96.327","0.008","90","","4050.4","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H44 N3 O11 Tb -","- C41 H44 N3 O11 Tb -","- C164 H176 N12 O44 Tb4 -","4","1","","Biju, Silvanose; Reddy, M. L. P.; Cowley, Alan H.; Vasudevan, Kalyan V.","3-Phenyl-4-acyl-5-isoxazolonate complex of Tb3+ doped into poly-β-hydroxybutyrate matrix as a promising light-conversion molecular device","Journal of Materials Chemistry","2009","19","29","5179","","10.1039/b905304b","","","0.71073","MoKα","","0.0816","0.0512","","","0.1125","0.1271","","","","","","1.197","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201135","13.9873","0.0013","7.41528","0.00052","23.3232","0.0054","90","","90","","90","","2419.1","0.6","","","","","","","","","","","","7","P n n m","-P 2 2n","58","","","","?","- Ce8 Ch8 N2 O68 Oh8 Si36 Wo12.696 -","- Ce8 Ch8 N2 O68 Oh8 Si36 Wo12.696 -","","","","Ikeda, Takuji; Kayamori, Syunsuke; Mizukami, Fujio","Synthesis and crystal structure of layered silicate PLS-3 and PLS-4 as a topotactic zeolite precursor","Journal of Materials Chemistry","2009","19","31","5518","","10.1039/b905415d","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201136","13.9766","0.0018","7.37483","0.00072","22.1964","0.0045","90","","89.804","0.016","90","","2287.9","0.6","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","?","- Ch19.512 H3.252 N3.252 O68 Oh8 Si36 -","- Ch19.512 H3.252 N3.252 O68 Oh8 Si36 -","","","","Ikeda, Takuji; Kayamori, Syunsuke; Mizukami, Fujio","Synthesis and crystal structure of layered silicate PLS-3 and PLS-4 as a topotactic zeolite precursor","Journal of Materials Chemistry","2009","19","31","5518","","10.1039/b905415d","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201176","8.3031","0.0007","28.945","0.002","15.8034","0.0014","90","","92.37","0.011","90","","3794.8","0.5","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-bis(E-dimesitylborylethenyl)benzene","","- C46 H52 B2 -","- C46 H52 B2 -","- C184 H208 B8 -","4","1","","Entwistle, Christopher D.; Collings, Jonathan C.; Steffen, Andreas; Pålsson, Lars-Olof; Beeby, Andrew; Albesa-Jové, David; Burke, Jacquelyn M.; Batsanov, Andrei S.; Howard, Judith A. K.; Mosely, Jackie A.; Poon, Suk-Yue; Wong, Wai-Yeung; Ibersiene, Fatima; Fathallah, Sofiane; Boucekkine, Abdou; Halet, Jean-François; Marder, Todd B.","Syntheses, structures, two-photon absorption cross-sections and computed second hyperpolarisabilities of quadrupolar A‒π‒A systems containing E-dimesitylborylethenyl acceptors","Journal of Materials Chemistry","2009","19","40","7532","","10.1039/b905719f","","","0.71073","MoKα","","0.083","0.0466","","","0.1239","0.1406","","","","","","1.023","","","","has coordinates,has disorder","180342","2020-10-21","18:00:00",""
"7201177","15.144","0.002","11.4882","0.0015","16.24","0.002","90","","99.46","0.02","90","","2787","0.6","110","2","110","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-bis(E-dimesitylborylethenyl)benzene, toluene trisolvate","","- C67 H76 B2 -","- C67 H76 B2 -","- C134 H152 B4 -","2","0.5","","Entwistle, Christopher D.; Collings, Jonathan C.; Steffen, Andreas; Pålsson, Lars-Olof; Beeby, Andrew; Albesa-Jové, David; Burke, Jacquelyn M.; Batsanov, Andrei S.; Howard, Judith A. K.; Mosely, Jackie A.; Poon, Suk-Yue; Wong, Wai-Yeung; Ibersiene, Fatima; Fathallah, Sofiane; Boucekkine, Abdou; Halet, Jean-François; Marder, Todd B.","Syntheses, structures, two-photon absorption cross-sections and computed second hyperpolarisabilities of quadrupolar A‒π‒A systems containing E-dimesitylborylethenyl acceptors","Journal of Materials Chemistry","2009","19","40","7532","","10.1039/b905719f","","","0.71073","MoKα","","0.094","0.0518","","","0.1183","0.1418","","","","","","1.031","","","","has coordinates,has disorder","180342","2020-10-21","18:00:00",""
"7201178","12.4785","0.0012","17.7688","0.0017","18.5164","0.0018","79.05","0.02","80.04","0.02","78.07","0.03","3905.4","0.8","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","2,5-bis(E-dimesitylborylethenyl)thiophene","","- C44.5 H51 B2 Cl S -","- C44.5 H51 B2 Cl S -","- C178 H204 B8 Cl4 S4 -","4","2","","Entwistle, Christopher D.; Collings, Jonathan C.; Steffen, Andreas; Pålsson, Lars-Olof; Beeby, Andrew; Albesa-Jové, David; Burke, Jacquelyn M.; Batsanov, Andrei S.; Howard, Judith A. K.; Mosely, Jackie A.; Poon, Suk-Yue; Wong, Wai-Yeung; Ibersiene, Fatima; Fathallah, Sofiane; Boucekkine, Abdou; Halet, Jean-François; Marder, Todd B.","Syntheses, structures, two-photon absorption cross-sections and computed second hyperpolarisabilities of quadrupolar A‒π‒A systems containing E-dimesitylborylethenyl acceptors","Journal of Materials Chemistry","2009","19","40","7532","","10.1039/b905719f","","","0.71073","MoKα","","0.0974","0.0604","","","0.1439","0.1684","","","","","","1.018","","","","has coordinates,has disorder","180342","2020-10-21","18:00:00",""
"7201179","15.3539","0.0012","16.3316","0.0011","21.5221","0.0016","90","","90.75","0.02","90","","5396.3","0.7","120","2","120","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","4,4'-bis(E-dimesitylborylethenyl)biphenyl, toluene solvate","","- C66 H72 B2 -","- C66 H72 B2 -","- C264 H288 B8 -","4","0.5","","Entwistle, Christopher D.; Collings, Jonathan C.; Steffen, Andreas; Pålsson, Lars-Olof; Beeby, Andrew; Albesa-Jové, David; Burke, Jacquelyn M.; Batsanov, Andrei S.; Howard, Judith A. K.; Mosely, Jackie A.; Poon, Suk-Yue; Wong, Wai-Yeung; Ibersiene, Fatima; Fathallah, Sofiane; Boucekkine, Abdou; Halet, Jean-François; Marder, Todd B.","Syntheses, structures, two-photon absorption cross-sections and computed second hyperpolarisabilities of quadrupolar A‒π‒A systems containing E-dimesitylborylethenyl acceptors","Journal of Materials Chemistry","2009","19","40","7532","","10.1039/b905719f","","","0.71073","MoKα","","0.1327","0.0765","","","0.1851","0.2276","","","","","","1.051","","","","has coordinates,has disorder","180342","2020-10-21","18:00:00",""
"7201180","11.7193","0.0009","12.0933","0.0009","18.1746","0.0014","84.01","0.03","78.79","0.02","81.32","0.02","2490.2","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","5,5'-bis(E-dimesitylborylethenyl)terthiophene, dichloromethane solvate","","- C53.5 H57 B2 Cl3 S3 -","- C53.5 H54 B2 Cl2.2 S3 -","- C107 H108 B4 Cl4.4 S6 -","2","1","","Entwistle, Christopher D.; Collings, Jonathan C.; Steffen, Andreas; Pålsson, Lars-Olof; Beeby, Andrew; Albesa-Jové, David; Burke, Jacquelyn M.; Batsanov, Andrei S.; Howard, Judith A. K.; Mosely, Jackie A.; Poon, Suk-Yue; Wong, Wai-Yeung; Ibersiene, Fatima; Fathallah, Sofiane; Boucekkine, Abdou; Halet, Jean-François; Marder, Todd B.","Syntheses, structures, two-photon absorption cross-sections and computed second hyperpolarisabilities of quadrupolar A‒π‒A systems containing E-dimesitylborylethenyl acceptors","Journal of Materials Chemistry","2009","19","40","7532","","10.1039/b905719f","","","0.71073","MoKα","","0.0952","0.0583","","","0.1506","0.1752","","","","","","1.024","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201183","11.6784","0.001","13.4373","0.0011","14.2959","0.0012","64.349","0.001","66.21","0.001","64.589","0.001","1760.2","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C83 H76 N8 O4 -","- C83 H68 N8 O4 -","- C83 H68 N8 O4 -","1","0.5","","Reddy, M. Ananth; Thomas, Anup; Srinivas, Kola; Rao, V. Jayathirtha; Bhanuprakash, K.; Sridhar, B.; Kumar, Arunandan; Kamalasanan, M. N.; Srivastava, Ritu","Synthesis and characterization of 9,10-bis(2-phenyl-1,3,4-oxadiazole) derivatives of anthracene: Efficient n-type emitter for organic light-emitting diodes","Journal of Materials Chemistry","2009","19","34","6172","","10.1039/b905808g","","","0.71073","MoKα","","0.0587","0.049","","","0.1401","0.151","","","","","","1.033","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201184","13.4303","0.0007","14.1082","0.0008","14.3536","0.0008","107.583","0.001","111.517","0.001","105.634","0.001","2178.9","0.2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H58 N4 O2 -","- C50 H58 N4 O2 -","- C100 H116 N8 O4 -","2","1","","Reddy, M. Ananth; Thomas, Anup; Srinivas, Kola; Rao, V. Jayathirtha; Bhanuprakash, K.; Sridhar, B.; Kumar, Arunandan; Kamalasanan, M. N.; Srivastava, Ritu","Synthesis and characterization of 9,10-bis(2-phenyl-1,3,4-oxadiazole) derivatives of anthracene: Efficient n-type emitter for organic light-emitting diodes","Journal of Materials Chemistry","2009","19","34","6172","","10.1039/b905808g","","","0.71073","MoKα","","0.087","0.0671","","","0.1924","0.2115","","","","","","1.077","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201236","7.0157","0.0008","6.4219","0.0013","35.465","0.005","90","","90","","92.255","0.013","1596.6","0.4","100","2","100","2","","","","","","","synthesis as described","7","P 1 1 21/a","-P 2ac","14","","","","- C22 H22 As F6 N2 O2 S12 -","- C22 H22 As F6 N2 O2 S12 -","- C44 H44 As2 F12 N4 O4 S24 -","2","0.5","","Zorina, Leokadiya; Simonov, Sergey; Mézière, Cécile; Canadell, Enric; Suh, Steve; Brown, Stuart E.; Foury-Leylekian, Pascale; Fertey, Pierre; Pouget, Jean-Paul; Batail, Patrick","Charge ordering, symmetry and electronic structure issues and Wigner crystal structure of the quarter-filled band Mott insulators and high pressure metals δ-(EDT-TTF-CONMe2)2X, X = Br and AsF6","Journal of Materials Chemistry","2009","19","38","6980","","10.1039/b906287d","","","0.71073","MoKα","","0.1471","0.0784","","","0.1832","0.216","","","","","","1.012","","","","has coordinates","180343","2020-10-21","18:00:00",""
"7201237","6.9762","0.0009","6.48","0.0012","32.671","0.009","90","","90","","92.446","0.018","1475.6","0.5","150","2","150","2","","","","","","","synthesis as described","6","P 1 1 21/a","-P 2ac","14","","","","- C22 H22 Br N2 O2 S12 -","- C22 H22 Br N2 O2 S12 -","- C44 H44 Br2 N4 O4 S24 -","2","0.5","","Zorina, Leokadiya; Simonov, Sergey; Mézière, Cécile; Canadell, Enric; Suh, Steve; Brown, Stuart E.; Foury-Leylekian, Pascale; Fertey, Pierre; Pouget, Jean-Paul; Batail, Patrick","Charge ordering, symmetry and electronic structure issues and Wigner crystal structure of the quarter-filled band Mott insulators and high pressure metals δ-(EDT-TTF-CONMe2)2X, X = Br and AsF6","Journal of Materials Chemistry","2009","19","38","6980","","10.1039/b906287d","","","0.71073","MoKα","","0.1026","0.0571","","","0.1274","0.1421","","","","","","1.002","","","","has coordinates,has disorder","180343","2020-10-21","18:00:00",""
"7201238","7.1097","0.0004","6.5049","0.0009","32.691","0.003","90","","90","","90","","1511.9","0.3","295","2","295","2","","","","","","","synthesis as described","6","P m n a","-P 2ac 2","53","","","","- C22 H22 Br N2 O2 S12 -","- C22 H22 Br N2 O2 S12 -","- C44 H44 Br2 N4 O4 S24 -","2","0.25","","Zorina, Leokadiya; Simonov, Sergey; Mézière, Cécile; Canadell, Enric; Suh, Steve; Brown, Stuart E.; Foury-Leylekian, Pascale; Fertey, Pierre; Pouget, Jean-Paul; Batail, Patrick","Charge ordering, symmetry and electronic structure issues and Wigner crystal structure of the quarter-filled band Mott insulators and high pressure metals δ-(EDT-TTF-CONMe2)2X, X = Br and AsF6","Journal of Materials Chemistry","2009","19","38","6980","","10.1039/b906287d","","","0.71073","MoKα","","0.0767","0.0331","","","0.0599","0.0676","","","","","","1.002","","","","has coordinates","180343","2020-10-21","18:00:00",""
"7201239","7.1126","0.0005","13.025","0.0007","32.759","0.0013","90","","90","","90","","3034.8","0.3","293","2","293","2","","","","","","","synthesis as described","6","P 2 n n","P -2n 2","34","","","","- C22 H22 Br N2 O2 S12 -","- C22 H22 Br N2 O2 S12 -","- C88 H88 Br4 N8 O8 S48 -","4","1","","Zorina, Leokadiya; Simonov, Sergey; Mézière, Cécile; Canadell, Enric; Suh, Steve; Brown, Stuart E.; Foury-Leylekian, Pascale; Fertey, Pierre; Pouget, Jean-Paul; Batail, Patrick","Charge ordering, symmetry and electronic structure issues and Wigner crystal structure of the quarter-filled band Mott insulators and high pressure metals δ-(EDT-TTF-CONMe2)2X, X = Br and AsF6","Journal of Materials Chemistry","2009","19","38","6980","","10.1039/b906287d","","x-ray","0.92072","synchrotron","","0.0962","0.0521","","","0.1418","0.1671","","","","","","1.006","","","","has coordinates,has disorder","180343","2020-10-21","18:00:00",""
"7201259","9.2735","0.0003","13.5383","0.0004","22.407","0.0007","90","","91.326","0.002","90","","2812.39","0.15","150","","150","","","","","","","","Simon Dalgleish, SD078","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 N2 Ni S6 -","- C28 H24 N2 Ni S6 -","- C112 H96 N8 Ni4 S24 -","4","1","","Dalgleish, Simon; Morrison, Carole A.; Middlemiss, Derek S.; Mount, Andrew R.; Collins, Anna; Pilia, Luca; Serpe, Angela; Mercuri, M. Laura; Roberts-Bleming, Susan J.; Charlton, Adam; Deplano, Paola; Murphy, Patrick J.; Robertson, Neil","Synthesis, structure and spectroscopic properties of a new class of polymerisable nickel dithiolenes","Journal of Materials Chemistry","2009","19","34","6194","","10.1039/b907028a","","","0.71073","MoKα","","0.0772","0.0521","","0.1355","0.1229","0.1355","","","","","","0.9346","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7201260","9.4169","0.0002","27.4559","0.0007","10.0584","0.0002","90","","114.935","0.001","90","","2358.18","0.09","150","","150","","","","","","","","Simon Dalgleish, SD068","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 N2 Ni S6 -","- C20 H24 N2 Ni S6 -","- C80 H96 N8 Ni4 S24 -","4","1","","Dalgleish, Simon; Morrison, Carole A.; Middlemiss, Derek S.; Mount, Andrew R.; Collins, Anna; Pilia, Luca; Serpe, Angela; Mercuri, M. Laura; Roberts-Bleming, Susan J.; Charlton, Adam; Deplano, Paola; Murphy, Patrick J.; Robertson, Neil","Synthesis, structure and spectroscopic properties of a new class of polymerisable nickel dithiolenes","Journal of Materials Chemistry","2009","19","34","6194","","10.1039/b907028a","","","0.71073","MoKα","","0.0551","0.044","","0.1109","0.1037","0.1109","","","","","","1.0145","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7201290","6.513","0.001","13.459","0.002","6.114","0.003","95.93","0.03","106.22","0.02","85.3","0.01","511.1","0.3","293.2","","","","","","","","","","","3","P -1","-P 1","2","Di(4-t-butylcyclopenteno(1,2-d)(1',2'-d)-1,4,5,8- tetrathiafulva-lene (1c)","","","- C20 H28 S4 -","- C20 H28 S4 -","- C20 H28 S4 -","1","0.5","","Kanno, Masato; Bando, Yoshimasa; Shirahata, Takashi; Inoue, Jun-ichi; Wada, Hiroshi; Mori, Takehiko","Stabilization of organic field-effect transistors in hexamethylenetetrathiafulvalene derivatives substituted by bulky alkyl groups","Journal of Materials Chemistry","2009","19","36","6548","","10.1039/b907592e","","","0.7107","MoKα","","","0.0347","","","","0.1012","","","","","","1.428","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7201291","6.477","0.001","14.667","0.003","6.14","0.003","93.38","0.03","93.66","0.02","86.5","0.02","580.1","0.3","293.2","","","","","","","","","","","3","P -1","-P 1","2","Di(4-n-butylcyclopenteno(1,2-d)(1',2'-d)-1,4,5,8-tetrathia- fulvalene (1d)","","","- C22 H32 S4 -","- C22 H32 S4 -","- C22 H32 S4 -","1","0.5","","Kanno, Masato; Bando, Yoshimasa; Shirahata, Takashi; Inoue, Jun-ichi; Wada, Hiroshi; Mori, Takehiko","Stabilization of organic field-effect transistors in hexamethylenetetrathiafulvalene derivatives substituted by bulky alkyl groups","Journal of Materials Chemistry","2009","19","36","6548","","10.1039/b907592e","","","0.7107","MoKα","","","0.0511","","","","0.1382","","","","","","1.89","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7201292","6.387","0.0009","14.408","0.003","6.32","0.001","93.17","0.02","110.22","0.01","91.12","0.01","544.45","0.17","293.2","","","","","","","","","","","3","P -1","-P 1","2","Di(4-(1,1-dimethylpropyl)penteno(1,2-d)(1',2'-d)-1,4,5,8- tetrathiafulvalene","","","- C22 H32 S4 -","- C22 H32 S4 -","- C22 H32 S4 -","1","0.5","","Kanno, Masato; Bando, Yoshimasa; Shirahata, Takashi; Inoue, Jun-ichi; Wada, Hiroshi; Mori, Takehiko","Stabilization of organic field-effect transistors in hexamethylenetetrathiafulvalene derivatives substituted by bulky alkyl groups","Journal of Materials Chemistry","2009","19","36","6548","","10.1039/b907592e","","","0.7107","MoKα","","","0.0321","","","","0.086","","","","","","1.144","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7201313","13.7734","0.0008","10.4858","0.0006","7.0995","0.0004","90","","102.906","0.001","90","","999.44","0.1","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C3 H7 N10, N O3, H2 O","","","- C3 H9 N11 O4 -","- C3 H9 N11 O4 -","- C12 H36 N44 O16 -","4","1","","Tao, Guo-Hong; Twamley, Brendan; Shreeve, Jean'ne M.","A thermally stable nitrogen-rich energetic material—3,4,5-triamino-1-tetrazolyl-1,2,4-triazole (TATT)","Journal of Materials Chemistry","2009","19","32","5850","","10.1039/b908214j","","","0.71073","MoKα","","0.0353","0.0327","","","0.0938","0.0968","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201323","18.9434","0.0015","4.6452","0.0004","25.872","0.003","90","","110.369","0.001","90","","2134.3","0.4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H4 Br N S3 -","- C9 H4 Br N S3 -","- C72 H32 Br8 N8 S24 -","8","1","","Morgan, Ian S.; D'Aleo, Danielle N.; Hudolin, Marissa L.; Chen, Aicheng; Assoud, Abdeljalil; Jenkins, Hilary A.; MacKinnon, Craig D.","Oligothiophenes substituted with the thionitrile group: synthesis, characterization, and thin-film formation on gold substrates","Journal of Materials Chemistry","2009","19","43","8162","","10.1039/b908869e","","","0.71073","MoKα","","0.0262","0.0217","","","0.0565","0.0584","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201324","3.9636","0.0012","16.715","0.005","8.572","0.003","90","","92.157","0.005","90","","567.5","0.3","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H4 N2 S4 -","- C10 H4 N2 S4 -","- C20 H8 N4 S8 -","2","0.5","","Morgan, Ian S.; D'Aleo, Danielle N.; Hudolin, Marissa L.; Chen, Aicheng; Assoud, Abdeljalil; Jenkins, Hilary A.; MacKinnon, Craig D.","Oligothiophenes substituted with the thionitrile group: synthesis, characterization, and thin-film formation on gold substrates","Journal of Materials Chemistry","2009","19","43","8162","","10.1039/b908869e","","","0.71073","MoKα","","0.0682","0.0651","","","0.1256","0.1268","","","","","","1.156","","","","has coordinates","180344","2020-10-21","18:00:00",""
"7201341","8.3567","0.0017","9.0434","0.0018","12.055","0.002","90","","90","","90","","911","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C4 H8 Cl N3 Ni O4 -","- C4 H8 Cl N3 Ni O4 -","- C16 H32 Cl4 N12 Ni4 O16 -","4","1","","Hu, Bo-Wen; Zhao, Jiong-Peng; Yang, Qian; Liu, Fu-Chen; Bu, Xian-He","Interconversion of two new nickel(II) coordination polymers with different topologies: synthesis, structure and magnetic properties","Journal of Materials Chemistry","2009","19","37","6827","","10.1039/b909683c","","","0.71073","MoKα","","0.0181","0.0174","","","0.0415","0.0418","","","","","","1.137","","","","has coordinates","180344","2020-10-21","18:00:00",""
"7201342","7.6673","0.0015","12.559","0.003","7.9117","0.0016","90","","118.58","0.03","90","","669","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H12 N6 Ni O6 -","- C8 H12 N6 Ni O6 -","- C16 H24 N12 Ni2 O12 -","2","0.5","","Hu, Bo-Wen; Zhao, Jiong-Peng; Yang, Qian; Liu, Fu-Chen; Bu, Xian-He","Interconversion of two new nickel(II) coordination polymers with different topologies: synthesis, structure and magnetic properties","Journal of Materials Chemistry","2009","19","37","6827","","10.1039/b909683c","","","0.71073","MoKα","","0.0348","0.03","","","0.0739","0.076","","","","","","1.133","","","","has coordinates","180344","2020-10-21","18:00:00",""
"7201399","10.1508","0.0011","12.2571","0.0013","16.6606","0.0018","79.161","0.002","77.551","0.002","88.507","0.002","1987.8","0.4","293","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C105 H80 Cl2 N4 O -","- C105 H72 Cl2 N4 O -","- C105 H72 Cl2 N4 O -","1","0.5","","Jiang, Zuoquan; Xu, Xichen; Zhang, Zhiqiang; Yang, Chuluo; Liu, Zhongyin; Tao, Youtian; Qin, Jingui; Ma, Dongge","Diarylmethylene-bridged 4,4′-(bis(9-carbazolyl))biphenyl: morphological stable host material for highly efficient electrophosphorescence","Journal of Materials Chemistry","2009","19","41","7661","","10.1039/b910247g","","","0.71073","MoKα","","0.1045","0.0868","","","0.2842","0.3095","","","","","","1.247","","","","has coordinates","180344","2020-10-21","18:00:00",""
"7201412","17.173","0.008","6.043","0.003","22.627","0.013","90","","103.433","0.018","90","","2284","2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C6-H2TPz","C6-H2TPz","","- C48 H58 N8 S4 -","- C48 H58 N8 S4 -","- C96 H116 N16 S8 -","2","0.5","","Miyazaki, Eigo; Kaku, Ayaka; Mori, Hiroki; Iwatani, Masahito; Takimiya, Kazuo","5-Hexylthiophene-fused porphyrazines: new soluble phthalocyanines for solution-processed organic electronic devices","Journal of Materials Chemistry","2009","19","33","5913","","10.1039/b910824f","","","0.71069","MoKα","","0.1696","0.0912","","","0.259","0.333","","","","","","0.97","","","","has coordinates,has disorder","180345","2020-10-21","18:00:00",""
"7201413","17.173","0.008","6.043","0.003","22.627","0.013","90","","103.433","0.018","90","","2284","2","100.2","","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","C6-CuTPz","C6-CuTPz","","- C48 H56 Cu N8 S4 -","- C48 H56 Cu N8 S4 -","- C96 H112 Cu2 N16 S8 -","2","0.5","","Miyazaki, Eigo; Kaku, Ayaka; Mori, Hiroki; Iwatani, Masahito; Takimiya, Kazuo","5-Hexylthiophene-fused porphyrazines: new soluble phthalocyanines for solution-processed organic electronic devices","Journal of Materials Chemistry","2009","19","33","5913","","10.1039/b910824f","","","0.71069","MoKα","","0.2808","0.0641","","","0.1413","0.2012","","","","","","0.658","","","","has coordinates,has disorder","180345","2020-10-21","18:00:00",""
"7201438","7.4155","0.0002","11.2295","0.0003","12.0044","0.0003","73.6103","0.0011","76.796","0.0011","74.4249","0.0011","911.11","0.04","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H50 S2 Si2 -","- C40 H50 S2 Si2 -","- C40 H50 S2 Si2 -","1","0.5","","Anthony, John E.; Subramanian, Sankar; Parkin, Sean R.; Park, Sung Kyu; Jackson, Thomas N.","Thin-film morphology and transistor performance of alkyl-substituted triethylsilylethynyl anthradithiophenes","Journal of Materials Chemistry","2009","19","42","7984","","10.1039/b911560a","","","0.71073","MoKα","","0.072","0.0515","","","0.1227","0.13","","","","","","1.152","","","","has coordinates,has disorder","180345","2020-10-21","18:00:00",""
"7201439","7.1419","0.0017","10.321","0.003","11.24","0.003","83.808","0.019","89.24","0.03","81.277","0.014","814.2","0.4","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H42 S2 Si2 -","- C36 H42 S2 Si2 -","- C36 H42 S2 Si2 -","1","0.5","","Anthony, John E.; Subramanian, Sankar; Parkin, Sean R.; Park, Sung Kyu; Jackson, Thomas N.","Thin-film morphology and transistor performance of alkyl-substituted triethylsilylethynyl anthradithiophenes","Journal of Materials Chemistry","2009","19","42","7984","","10.1039/b911560a","","","0.71073","MoKα","","0.0955","0.0508","","","0.1238","0.1426","","","","","","1.03","","","","has coordinates,has disorder","180345","2020-10-21","18:00:00",""
"7201440","7.9028","0.0003","10.4873","0.0004","10.8412","0.0005","76.3218","0.0018","88.4391","0.0017","88.963","0.0019","872.64","0.06","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C38 H46 S2 Si2 -","- C38 H46 S2 Si2 -","- C38 H46 S2 Si2 -","1","0.5","","Anthony, John E.; Subramanian, Sankar; Parkin, Sean R.; Park, Sung Kyu; Jackson, Thomas N.","Thin-film morphology and transistor performance of alkyl-substituted triethylsilylethynyl anthradithiophenes","Journal of Materials Chemistry","2009","19","42","7984","","10.1039/b911560a","","","0.71073","MoKα","","0.0844","0.0542","","","0.1401","0.1585","","","","","","1.043","","","","has coordinates,has disorder","180345","2020-10-21","18:00:00",""
"7201447","19.6252","0.0012","4.5677","0.0003","23.5052","0.0014","90","","101.237","0.001","90","","2066.7","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C50 H66 S2 -","- C50 H66 S2 -","- C100 H132 S4 -","2","0.5","","Luo, Jing; Qu, Hemi; Yin, Jun; Zhang, Xiaojie; Huang, Kuo-Wei; Chi, Chunyan","π-Conjugated oligothiophene‒anthracene co-oligomers: synthesis, physical properties, and self-assembly","Journal of Materials Chemistry","2009","19","43","8202","","10.1039/b911911f","","","0.71073","MoKα","","0.0538","0.0505","","","0.1278","0.1305","","","","","","1.062","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201448","5.5798","0.0003","7.4484","0.0004","58.222","0.003","90","","92.516","0.001","90","","2417.4","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C58 H70 S4 -","- C58 H70 S4 -","- C116 H140 S8 -","2","0.5","","Luo, Jing; Qu, Hemi; Yin, Jun; Zhang, Xiaojie; Huang, Kuo-Wei; Chi, Chunyan","π-Conjugated oligothiophene‒anthracene co-oligomers: synthesis, physical properties, and self-assembly","Journal of Materials Chemistry","2009","19","43","8202","","10.1039/b911911f","","","0.71073","MoKα","","0.066","0.0607","","","0.1359","0.1383","","","","","","1.21","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201463","6.1973","0.0012","4.7149","0.0007","27.494","0.005","90","","95.383","0.011","90","","799.8","0.2","113","2","113","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H8 S6 -","- C18 H8 S6 -","- C36 H16 S12 -","2","0.5","","Zhang, Lei; Tan, Lin; Hu, Wenping; Wang, Zhaohui","Synthesis, packing arrangement and transistor performance of dimers of dithienothiophenes","Journal of Materials Chemistry","2009","19","43","8216","","10.1039/b913340b","","","0.7107","MoKα","","0.0545","0.0419","","","0.0837","0.0898","","","","","","1.104","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201467","9.766","0.002","10.481","0.003","12.098","0.003","93.804","0.009","90.249","0.01","102.587","0.01","1205.7","0.5","95","2","95","2","","","","","","","","4","P -1","-P 1","2","cmc0545a","","","- C19 H44 B9 N -","- C19 H44 B9 N -","- C38 H88 B18 N2 -","2","1","","Ringstrand, Bryan; Kaszynski, Piotr; Januszko, Adam; Young, Victor G.","Polar derivatives of the [closo-1-CB9H10]− cluster as positive Δε additives to nematic hosts","Journal of Materials Chemistry","2009","19","48","9204","","10.1039/b913701g","","","0.49595","synchrotron","","0.0747","0.0641","","","0.1789","0.1859","","","","","","1.079","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201472","10.1336","0.0005","16.7572","0.0008","16.207","0.0008","90","","95.402","0.002","90","","2739.9","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H32 Cu2 Mn2 N2 O24 P2 -","- C10 H32 Cu2 Mn2 N2 O24 P2 -","- C40 H128 Cu8 Mn8 N8 O96 P8 -","4","1","","Gu, Zhi-Guo; Sevov, Slavi C.","Syntheses, structures, and magnetic properties of heterometallic coordination polymers with carboxyphosphonate linkers","Journal of Materials Chemistry","2009","19","44","8442","","10.1039/b915459k","","","0.71073","MoKα","","0.0389","0.036","","","0.0925","0.0944","","","","","","1.035","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201473","10.0105","0.0004","16.705","0.0007","15.9762","0.0007","90","","95.628","0.002","90","","2658.75","0.19","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H32 Co2 Cu2 N2 O24 P2 -","- C10 H32 Co2 Cu2 N2 O24 P2 -","- C40 H128 Co8 Cu8 N8 O96 P8 -","4","1","","Gu, Zhi-Guo; Sevov, Slavi C.","Syntheses, structures, and magnetic properties of heterometallic coordination polymers with carboxyphosphonate linkers","Journal of Materials Chemistry","2009","19","44","8442","","10.1039/b915459k","","","0.71073","MoKα","","0.043","0.0405","","","0.1066","0.108","","","","","","1.172","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201474","10.2176","0.0004","16.7881","0.0007","16.2442","0.0006","90","","95.647","0.002","90","","2772.91","0.19","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H32 Cd2 Cu2 N2 O24 P2 -","- C10 H32 Cd2 Cu2 N2 O24 P2 -","- C40 H128 Cd8 Cu8 N8 O96 P8 -","4","1","","Gu, Zhi-Guo; Sevov, Slavi C.","Syntheses, structures, and magnetic properties of heterometallic coordination polymers with carboxyphosphonate linkers","Journal of Materials Chemistry","2009","19","44","8442","","10.1039/b915459k","","","0.71073","MoKα","","0.0481","0.0446","","","0.1169","0.1188","","","","","","1.165","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201475","8.3028","0.0003","20.6398","0.0008","9.463","0.0004","90","","109.867","0.002","90","","1525.14","0.11","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H62 Cu4 La4 N4 O55 P4 -","- C24 H62 Cu4 La4 N4 O55 P4 -","- C24 H62 Cu4 La4 N4 O55 P4 -","1","0.25","","Gu, Zhi-Guo; Sevov, Slavi C.","Syntheses, structures, and magnetic properties of heterometallic coordination polymers with carboxyphosphonate linkers","Journal of Materials Chemistry","2009","19","44","8442","","10.1039/b915459k","","","0.71073","MoKα","","0.0313","0.029","","","0.0656","0.0664","","","","","","1.159","","","","has coordinates,has disorder","180345","2020-10-21","18:00:00",""
"7201476","8.2368","0.0002","20.366","0.0005","9.4063","0.0002","90","","110.286","0.001","90","","1480.04","0.06","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H62 Cu4 N4 Nd4 O55 P4 -","- C24 H62 Cu4 N4 Nd4 O55 P4 -","- C24 H62 Cu4 N4 Nd4 O55 P4 -","1","0.25","","Gu, Zhi-Guo; Sevov, Slavi C.","Syntheses, structures, and magnetic properties of heterometallic coordination polymers with carboxyphosphonate linkers","Journal of Materials Chemistry","2009","19","44","8442","","10.1039/b915459k","","","0.71073","MoKα","","0.0253","0.0235","","","0.0576","0.0584","","","","","","1.076","","","","has coordinates,has disorder","180345","2020-10-21","18:00:00",""
"7201485","8.9808","0.0018","16.334","0.003","22.781","0.005","90","","90.39","0.03","90","","3341.7","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H35 Ir N4 S2 -","- C39 H35 Ir N4 S2 -","- C156 H140 Ir4 N16 S8 -","4","1","","Peng, Tai; Bi, Hai; Liu, Yu; Fan, Yan; Gao, Hongze; Wang, Yue; Hou, Zhaomin","Very high-efficiency red-electroluminescence devices based on an amidinate-ligated phosphorescent iridium complex","Journal of Materials Chemistry","2009","19","43","8072","","10.1039/b917776k","","","0.71073","MoKα","","0.0423","0.0316","","","0.0826","0.0877","","","","","","0.952","","","","has coordinates","180345","2020-10-21","18:00:00",""
"7201564","13.22","0.003","13.543","0.003","19.421","0.004","99.88","0.03","102.01","0.03","96.01","0.03","3314.8","1.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","6,7-dicyano-2,3-di-(4-(2,3,4,5- tetraphenylphenyl)phenyl)quinoxaline","","","- C82.75 H53.5 Cl1.5 N4 O2.5 -","- C82.748 H53.496 Cl1.496 N4 O2.454 -","- C165.496 H106.992 Cl2.992 N8 O4.908 -","2","1","","Xu, Xinjun; Yu, Gui; Chen, Shiyan; Di, Chong'an; Liu, Yunqi","Synthesis and characterization of a quinoxaline compound containing polyphenylphenyl and strong electron-accepting groups, and its multiple applications in electroluminescent devices","Journal of Materials Chemistry","2008","18","3","299","","10.1039/b710139b","","","0.71069","MoKα","","0.2187","0.1102","","","0.296","0.3199","","","","","","1.41","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7201667","7.81357","0.00009","20.39273","0.00027","6.849","0.00008","90","","92.4813","0.0007","90","","1090.3","0.02","300","","","","","","","","","","","4","C 1 c 1","C -2yc","9","Zn+1,3-adamantandicarboxylsyre","","","- C12 H14 O4 Zn -","- C12 H14 O4 Zn -","- C48 H56 O16 Zn4 -","4","1","","Nielsen, Renie Birkedal; Kongshaug, Kjell Ove; Fjellvåg, Helmer","Delamination, synthesis, crystal structure and thermal properties of the layered metal-organic compound Zn(C12H14O4)","Journal of Materials Chemistry","2008","18","9","1002","","10.1039/b712479a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180347","2020-10-21","18:00:00",""
"7201721","22.3534","0.0004","22.3534","0.0003","41.1462","0.0003","90","","90","","120","","17805.2","0.4","233","2","233","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C89.6 H76.4 Cl18 Cu6 N6 O43 -","- C89.6 H24 Cl18 Cu6 N6 O43.02 -","- C537.6 H144 Cl108 Cu36 N36 O258.12 -","6","0.166667","","Roques, Nans; Maspoch, Daniel; Luis, Fernando; Camón, Agustín; Wurst, Klaus; Datcu, Angela; Rovira, Concepció; Ruiz-Molina, Daniel; Veciana, Jaume","A hexacarboxylic open-shell building block: synthesis, structure and magnetism of a three-dimensional metal‒radical framework","Journal of Materials Chemistry","2008","18","1","98","","10.1039/b713705b","","","0.71073","MoKα","","0.0772","0.0656","","","0.1883","0.1973","","","","","","1.061","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7201722","22.4479","0.0005","22.4479","0.0007","41.172","0.0006","90","","90","","120","","17967.4","0.7","233","2","233","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C98 H94 Cl18 Cu6 N6 O40 -","- C98 H74 Cl18 Cu6 N6 O40 -","- C588 H444 Cl108 Cu36 N36 O240 -","6","0.166667","","Roques, Nans; Maspoch, Daniel; Luis, Fernando; Camón, Agustín; Wurst, Klaus; Datcu, Angela; Rovira, Concepció; Ruiz-Molina, Daniel; Veciana, Jaume","A hexacarboxylic open-shell building block: synthesis, structure and magnetism of a three-dimensional metal‒radical framework","Journal of Materials Chemistry","2008","18","1","98","","10.1039/b713705b","","","0.71073","MoKα","","0.0624","0.0506","","","0.1336","0.1409","","","","","","1.074","","","","has coordinates","180348","2020-10-21","18:00:00",""
"7201731","10.484","0.003","10.86","0.003","14.752","0.003","93.617","0.004","104.214","0.004","98.912","0.004","1599.5","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H37 N O10 Pt -","- C35 H37 N O10 Pt -","- C70 H74 N2 O20 Pt2 -","2","1","","Venkatesan, Koushik; Kouwer, Paul H. J.; Yagi, Shigeyuki; Müller, Peter; Swager, Timothy M.","Columnar mesophases from half-discoid platinum cyclometalated metallomesogens","Journal of Materials Chemistry","2008","18","4","400","","10.1039/b714291a","","","0.71073","MoKα","","0.0225","0.0203","","","0.0505","0.0516","","","","","","1.077","","","","has coordinates","180348","2020-10-21","18:00:00",""
"7201732","20.996","0.0019","10.4617","0.001","15.1265","0.0014","90","","112.473","0.001","90","","3070.3","0.5","100","2","100","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C31 H31 Cl2 N O8 Pt S -","- C31 H31 Cl2 N O8 Pt S -","- C124 H124 Cl8 N4 O32 Pt4 S4 -","4","1","","Venkatesan, Koushik; Kouwer, Paul H. J.; Yagi, Shigeyuki; Müller, Peter; Swager, Timothy M.","Columnar mesophases from half-discoid platinum cyclometalated metallomesogens","Journal of Materials Chemistry","2008","18","4","400","","10.1039/b714291a","","","0.71073","MoKα","","0.015","0.0142","","","0.0248","0.025","","","","","","0.988","","","","has coordinates,has disorder","180348","2020-10-21","18:00:00",""
"7201733","12.112","0.002","5.4414","0.0011","17.026","0.003","90","","110.51","0.03","90","","1051","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","C20 H12 Ni1 S8","","","- C20 H12 Ni S8 -","- C20 H12 Ni S8 -","- C40 H24 Ni2 S16 -","2","0.5","","Anjos, Tania; Roberts-Bleming, Susan J.; Charlton, Adam; Robertson, Neil; Mount, Andrew R.; Coles, Simon J.; Hursthouse, Michael B.; Kalaji, Maher; Murphy, Patrick J.","Nickel dithiolenes containing pendant thiophene units: precursors to dithiolene‒polythiophene hybrid materials","Journal of Materials Chemistry","2008","18","4","475","","10.1039/b714372a","","","0.71073","MoKα","","0.0369","0.03","","","0.0703","0.0735","","","","","","1.066","","","","has coordinates,has disorder","180348","2020-10-21","18:00:00",""
"7201734","9.5217","0.0019","9.81","0.002","11.985","0.002","90.14","0.03","100.37","0.03","93.73","0.03","1098.8","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","C20 H8 Ni1 S8","","","- C20 H12 Ni S8 -","- C20 H12 Ni S8 -","- C40 H24 Ni2 S16 -","2","1","","Anjos, Tania; Roberts-Bleming, Susan J.; Charlton, Adam; Robertson, Neil; Mount, Andrew R.; Coles, Simon J.; Hursthouse, Michael B.; Kalaji, Maher; Murphy, Patrick J.","Nickel dithiolenes containing pendant thiophene units: precursors to dithiolene‒polythiophene hybrid materials","Journal of Materials Chemistry","2008","18","4","475","","10.1039/b714372a","","","0.71073","MoKα","","0.0428","0.0356","","","0.0928","0.0977","","","","","","1.052","","","","has coordinates,has disorder","180348","2020-10-21","18:00:00",""
"7201752","6.0191","0.0011","9.059","0.002","17.191","0.006","100.69","0.02","95.305","0.019","91.741","0.015","916.1","0.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H34 N2 S -","- C50 H34 N2 S -","- C50 H34 N2 S -","1","0.5","","Wei, Peng; Duan, Lian; Zhang, Deqiang; Qiao, Juan; Wang, Liduo; Wang, Ruji; Dong, Guifang; Qiu, Yong","A new type of light-emitting naphtho[2,3-c][1,2,5]thiadiazole derivatives: synthesis, photophysical characterization and transporting properties","Journal of Materials Chemistry","2008","18","7","806","","10.1039/b714539j","","","0.71073","MoKα","","0.2145","0.1114","","","0.2111","0.2355","","","","","","1.069","","","","has coordinates,has disorder","180348","2020-10-21","18:00:00",""
"7201753","9.3698","0.001","28.45","0.003","9.4857","0.0011","90","","107.178","0.003","90","","2415.8","0.5","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H22 N2 S -","- C34 H22 N2 S -","- C136 H88 N8 S4 -","4","0.5","","Wei, Peng; Duan, Lian; Zhang, Deqiang; Qiao, Juan; Wang, Liduo; Wang, Ruji; Dong, Guifang; Qiu, Yong","A new type of light-emitting naphtho[2,3-c][1,2,5]thiadiazole derivatives: synthesis, photophysical characterization and transporting properties","Journal of Materials Chemistry","2008","18","7","806","","10.1039/b714539j","","","0.71073","MoKα","","0.1079","0.0727","","","0.1376","0.1501","","","","","","1.032","","","","has coordinates,has disorder","180348","2020-10-21","18:00:00",""
"7201779","9.41","0.002","9.41","0.002","17.809","0.004","90","","90","","120","","1365.7","0.5","293","2","293","2","","","","","","","","6","P 63","P 6c","173","","","","- C26 H41 Cr Mn N3 O14 -","- C17.88 H26.73 Cr Mn N O12 -","- C35.76 H53.46 Cr2 Mn2 N2 O24 -","2","0.333333","","Coronado, Eugenio; Giménez-Saiz, Carlos; Gómez-García, Carlos J.; Romero, Francisco M.; Tarazón, Ana","Layered ferromagnets hosting tetraalkylammonium-substituted nitronyl nitroxide free radicals","Journal of Materials Chemistry","2008","18","8","929","","10.1039/b715739h","","","0.71073","MoKα","","0.2","0.0967","","","0.2294","0.279","","","","","","1.051","","","","has coordinates,has disorder","180348","2020-10-21","18:00:00",""
"7201782","33.557","0.01","15.363","0.005","13.991","0.005","90","","98.497","0.006","90","","7134","4","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C41 H36 N4 S2 -","- C41 H36 N4 S2 -","- C328 H288 N32 S16 -","8","1","","Qi, Ting; Liu, Yunqi; Qiu, Wenfeng; Zhang, Hengjun; Gao, Xike; Liu, Ying; Lu, Kun; Du, Chunyan; Yu, Gui; Zhu, Daoben","Synthesis and properties of fluorene or carbazole-based and dicyanovinyl-capped n-type organic semiconductors","Journal of Materials Chemistry","2008","18","10","1131","","10.1039/b715920j","","","0.71073","MoKα","","0.2002","0.0637","","","0.1265","0.1711","","","","","","0.92","","","","has coordinates,has disorder","180348","2020-10-21","18:00:00",""
"7201801","7.0996","0.0013","6.8561","0.0012","8.9728","0.0016","90","","94.854","0.003","90","","435.19","0.13","100","2","100","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C H3 B Cl5 N Si -","- C H3 B Cl5 N Si -","- C2 H6 B2 Cl10 N2 Si2 -","2","0.5","","Weinmann, Markus; Kroschel, Matthias; Jäschke, Thomas; Nuss, Jürgen; Jansen, Martin; Kolios, Grigorios; Morillo, Aristides; Tellaeche, Carlos; Nieken, Ulrich","Towards continuous processes for the synthesis of precursors of amorphous Si/B/N/C ceramics","Journal of Materials Chemistry","2008","18","15","1810","","10.1039/b716144a","","","0.71073","MoKα","","0.0312","0.0273","","","0.0672","0.0697","","","","","","1.076","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201820","12.585","0.0013","12.9929","0.0013","14.2161","0.0015","110.801","0.012","114.727","0.013","97.63","0.012","1862.3","0.5","180","","180","","","","","","","","","4","P -1","-P 1","2","","","","- C68 H89 O19 Sn6 -","- C68 H89 O19 Sn6 -","- C68 H89 O19 Sn6 -","1","0.5","","Delavaux-Nicot, Béatrice; Kaeser, Adrien; Hahn, Uwe; Gégout, Aline; Brandli, Pierre-Elie; Duhayon, Carine; Coppel, Yannick; Saquet, Alix; Nierengarten, Jean-François","Organotin chemistry for the preparation of fullerene-rich nanostructures","Journal of Materials Chemistry","2008","18","13","1547","","10.1039/b716506d","","","0.71073","MoKα","","0.048","0.0397","","0.0519","0.0484","0.0484","","","","","","1.0821","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201826","13.7062","0.0005","21.5592","0.0008","22.5411","0.0008","90","","94.493","0.002","90","","6640.3","0.4","193","2","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H33 Cl6 N S Sb -","- C32 H33 Cl6 N S Sb -","- C256 H264 Cl48 N8 S8 Sb8 -","8","2","","Oka, Hiroyuki","Synthesis and through-bond spin interaction of stable 1,3-phenylene linked poly(phenothiazine cation radical)","Journal of Materials Chemistry","2008","18","16","1927","","10.1039/b716919a","","","0.7107","MoKα","","0.059","0.0526","","","0.1083","0.1113","","","","","","1.17","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7201834","19.8513","0.0004","5.3006","0.0001","22.6989","0.0005","90","","93.5526","0.0008","90","","2383.87","0.08","90","0.2","90","0.2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 -","- C34 H30 -","- C136 H120 -","4","1","","Chen, Jihua; Subramanian, Sankar; Parkin, Sean R.; Siegler, Maxime; Gallup, Kaitlin; Haughn, Chelsea; Martin, David C.; Anthony, John E.","The influence of side chains on the structures and properties of functionalized pentacenes","Journal of Materials Chemistry","2008","18","17","1961","","10.1039/b717082c","","","0.71073","MoKα","","0.1165","0.0482","","","0.0949","0.1163","","","","","","0.98","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201835","6.6368","0.0001","8.3446","0.0002","13.7421","0.0003","105.526","0.0009","100.252","0.0009","92.736","0.0009","717.92","0.03","90","0.2","90","2","","","","","","","","2","P -1","-P 1","2","","","","- C38 H38 -","- C38 H38 -","- C38 H38 -","1","0.5","","Chen, Jihua; Subramanian, Sankar; Parkin, Sean R.; Siegler, Maxime; Gallup, Kaitlin; Haughn, Chelsea; Martin, David C.; Anthony, John E.","The influence of side chains on the structures and properties of functionalized pentacenes","Journal of Materials Chemistry","2008","18","17","1961","","10.1039/b717082c","","","0.71073","MoKα","","0.0865","0.0474","","","0.1145","0.1343","","","","","","0.993","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201836","12.3212","0.0003","5.142","0.0002","20.803","0.0007","90","","101.16","0.0012","90","","1293.06","0.07","90","0.2","90","0.2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C36 H34 -","- C36 H34 -","- C72 H68 -","2","0.5","","Chen, Jihua; Subramanian, Sankar; Parkin, Sean R.; Siegler, Maxime; Gallup, Kaitlin; Haughn, Chelsea; Martin, David C.; Anthony, John E.","The influence of side chains on the structures and properties of functionalized pentacenes","Journal of Materials Chemistry","2008","18","17","1961","","10.1039/b717082c","","","0.71073","MoKα","","0.1015","0.051","","","0.1073","0.1259","","","","","","0.975","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201837","8.8577","0.0001","11.129","0.0001","12.5975","0.0001","101.919","0.0004","93.8211","0.0004","101.29","0.0004","1184.1","0.02","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C54 H74 Si2 -","- C54 H74 Si2 -","- C54 H74 Si2 -","1","0.5","","Chen, Jihua; Subramanian, Sankar; Parkin, Sean R.; Siegler, Maxime; Gallup, Kaitlin; Haughn, Chelsea; Martin, David C.; Anthony, John E.","The influence of side chains on the structures and properties of functionalized pentacenes","Journal of Materials Chemistry","2008","18","17","1961","","10.1039/b717082c","","","0.71073","MoKα","","0.0435","0.0366","","","0.1005","0.1053","","","","","","1.006","","","","has coordinates,has disorder","180349","2020-10-21","18:00:00",""
"7201838","8.884","0.0002","22.324","0.0005","10.797","0.0003","90","","110.146","0.001","90","","2010.32","0.09","90","0.2","90","0.2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C46 H58 Si2 -","- C46 H58 Si2 -","- C92 H116 Si4 -","2","0.5","","Chen, Jihua; Subramanian, Sankar; Parkin, Sean R.; Siegler, Maxime; Gallup, Kaitlin; Haughn, Chelsea; Martin, David C.; Anthony, John E.","The influence of side chains on the structures and properties of functionalized pentacenes","Journal of Materials Chemistry","2008","18","17","1961","","10.1039/b717082c","","","0.71073","MoKα","","0.0973","0.0503","","","0.1143","0.1331","","","","","","1.049","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201839","10.6177","0.0002","13.6171","0.0003","14.0829","0.0003","75.154","0.001","73.915","0.001","71.123","0.001","1819.86","0.07","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C42 H50 Si2 -","- C42 H50 Si2 -","- C84 H100 Si4 -","2","1","","Chen, Jihua; Subramanian, Sankar; Parkin, Sean R.; Siegler, Maxime; Gallup, Kaitlin; Haughn, Chelsea; Martin, David C.; Anthony, John E.","The influence of side chains on the structures and properties of functionalized pentacenes","Journal of Materials Chemistry","2008","18","17","1961","","10.1039/b717082c","","","1.54178","CuKα","","0.1097","0.0769","","","0.2086","0.2414","","","","","","1.028","","","","has coordinates,has disorder","180349","2020-10-21","18:00:00",""
"7201840","10.3715","0.0002","15.4649","0.0002","27.5066","0.0004","90","","90","","90","","4411.9","0.12","90","0.2","90","0.2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C50 H66 Si2 -","- C50 H66 Si2 -","- C200 H264 Si8 -","4","0.5","","Chen, Jihua; Subramanian, Sankar; Parkin, Sean R.; Siegler, Maxime; Gallup, Kaitlin; Haughn, Chelsea; Martin, David C.; Anthony, John E.","The influence of side chains on the structures and properties of functionalized pentacenes","Journal of Materials Chemistry","2008","18","17","1961","","10.1039/b717082c","","","1.54178","CuKα","","0.0429","0.036","","","0.0931","0.0985","","","","","","1.037","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201871","27.474","0.006","11.463","0.003","7.459","0.0014","90","","96.485","0.016","90","","2334.1","0.9","293","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4,5-ethylnenedioxy-4'methyltetrathiafulvalene","4,5-ethylnenedioxy-4'methyltetrathiafulvalene","","- C9 H8 O2 S4 -","- C9 H8 O2 S4 -","- C72 H64 O16 S32 -","8","2","","Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Dubrovskiy, Alexander D.; Otsuka, Akihiro; Murata, Tsuyoshi; Yoshida, Yukihiro; Saito, Gunzi; Koshihara, Shin-ya","Formation of two-dimensional metals by weak intermolecular interactions based on the asymmetric EDO-TTF derivatives","Journal of Materials Chemistry","2008","18","18","2131","","10.1039/b717621j","","","0.71073","MoKα","","0.0546","0.0546","","","0.1701","0.1701","","","","","","1.212","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201872","13.681","0.001","17.438","0.0013","10.53","0.0006","90","","90","","90","","2512.1","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","4,5-ethylenedioxy-4'-methylthiotetrathiafulvalene'","4,5-ethylenedioxy-4'-methylthiotetrathiafulvalene'","","- C9 H8 O2 S5 -","- C9 H8 O2 S5 -","- C72 H64 O16 S40 -","8","1","","Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Dubrovskiy, Alexander D.; Otsuka, Akihiro; Murata, Tsuyoshi; Yoshida, Yukihiro; Saito, Gunzi; Koshihara, Shin-ya","Formation of two-dimensional metals by weak intermolecular interactions based on the asymmetric EDO-TTF derivatives","Journal of Materials Chemistry","2008","18","18","2131","","10.1039/b717621j","","","0.71069","MoKα","","0.0772","0.0489","","","0.1304","0.1441","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7201873","28.752","0.0017","12.369","0.0012","6.969","0.0008","90","","90","","90","","2478.4","0.4","295","2","295","2","","","","","","","","6","C m c m","-C 2c 2","63","bis-4,5-ethylenedioxy-4'-methyltetrathiafulvalene- tetrafluoroborate","bis-4,5-ethylenedioxy-4'-methyltetrathiafulvalene-tetrafluoroborate","","- C18 H16 B F4 O4 S8 -","- C18 H8 B F3.5 O4 S8 -","- C72 H32 B4 F14 O16 S32 -","4","0.25","","Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Dubrovskiy, Alexander D.; Otsuka, Akihiro; Murata, Tsuyoshi; Yoshida, Yukihiro; Saito, Gunzi; Koshihara, Shin-ya","Formation of two-dimensional metals by weak intermolecular interactions based on the asymmetric EDO-TTF derivatives","Journal of Materials Chemistry","2008","18","18","2131","","10.1039/b717621j","","","0.71073","MoKα","","0.0725","0.0574","","","0.1644","0.1793","","","","","","1.044","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201874","29.107","0.003","12.412","0.0006","6.962","0.0007","90","","90","","90","","2515.2","0.4","295","2","295","2","","","","","","","","5","C m c m","-C 2c 2","63","bis-4,5-ethylenedioxy-4'-methyltetrathiafulvalene-perchlorate","bis-4,5-ethylenedioxy-4'-methyltetrathiafulvalene-perchlorate","","- C18 H16 Cl O8 S8 -","- C18 H8 Cl O7.5 S8 -","- C72 H32 Cl4 O30 S32 -","4","0.25","","Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Dubrovskiy, Alexander D.; Otsuka, Akihiro; Murata, Tsuyoshi; Yoshida, Yukihiro; Saito, Gunzi; Koshihara, Shin-ya","Formation of two-dimensional metals by weak intermolecular interactions based on the asymmetric EDO-TTF derivatives","Journal of Materials Chemistry","2008","18","18","2131","","10.1039/b717621j","","","0.71073","MoKα","","0.0654","0.0492","","","0.1471","0.162","","","","","","1.054","","","","has coordinates","180349","2020-10-21","18:00:00",""
"7201916","7.9605","0.0005","17.0682","0.0013","22.327","0.0017","69.628","0.004","89.239","0.004","79.236","0.004","2789.4","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","(n-Bu!4$N)!2$(Ni(dcbdt)!2$)!5$!","","","- C112 H92 N22 Ni5 S20 -","- C112 H92 N22 Ni5 S20 -","- C112 H92 N22 Ni5 S20 -","1","0.5","","Lopes, Elsa B.; Alves, Helena; Santos, Isabel C.; Graf, David; Brooks, James S.; Canadell, Enric; Almeida, Manuel","The family of molecular conductors [(n-Bu)4N]2[M(dcbdt)2]5, M = Cu, Ni, Au; band filling and stacking modulation effects","Journal of Materials Chemistry","2008","18","24","2825","","10.1039/b719418h","","","0.71073","MoKα","","0.2184","0.0726","","","0.1229","0.1472","","","","","","0.882","","","","has coordinates","180350","2020-10-21","18:00:00",""
"7201917","7.973","0.004","17.322","0.003","23.171","0.004","68.119","0.009","88.882","0.008","78.409","0.009","2903.6","1.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","(n-Bu!4$N)!2$(Au(dcbdt)!2$)!5$!","","","- C112 H92 Au5 N22 S20 -","- C112 H92 Au5 N22 S20 -","- C112 H92 Au5 N22 S20 -","1","0.5","","Lopes, Elsa B.; Alves, Helena; Santos, Isabel C.; Graf, David; Brooks, James S.; Canadell, Enric; Almeida, Manuel","The family of molecular conductors [(n-Bu)4N]2[M(dcbdt)2]5, M = Cu, Ni, Au; band filling and stacking modulation effects","Journal of Materials Chemistry","2008","18","24","2825","","10.1039/b719418h","","","0.71069","MoKα","","0.2473","0.0801","","","0.0987","0.1242","","","","","","0.885","","","","has coordinates","180350","2020-10-21","18:00:00",""
"7201918","7.9351","0.0001","17.0822","0.0003","22.9746","0.0004","68.763","0.002","88.809","0.001","78.163","0.001","2836.08","0.09","120","2","120","2","","","","","","","","5","P -1","-P 1","2","(n-Bu!4$N)!2$(Au(dcbdt)!2$)!5$!","","","- C112 H92 Au5 N22 S20 -","- C112 H92 Au5 N22 S20 -","- C112 H92 Au5 N22 S20 -","1","0.5","","Lopes, Elsa B.; Alves, Helena; Santos, Isabel C.; Graf, David; Brooks, James S.; Canadell, Enric; Almeida, Manuel","The family of molecular conductors [(n-Bu)4N]2[M(dcbdt)2]5, M = Cu, Ni, Au; band filling and stacking modulation effects","Journal of Materials Chemistry","2008","18","24","2825","","10.1039/b719418h","","","0.71073","MoKα","","0.0375","0.0245","","","0.0529","0.0565","","","","","","1.006","","","","has coordinates","180350","2020-10-21","18:00:00",""
"7201956","15.6727","0.0019","20.528","0.002","17.462","0.002","90","","91.444","0.002","90","","5616.3","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H48 Cl3 Ir N6 O3 -","- C66 H48 Cl3 Ir N6 O3 -","- C264 H192 Cl12 Ir4 N24 O12 -","4","1","","Tong, Bihai; Mei, Qunbo; Wang, Shuanjin; Fang, Yuan; Meng, Yuezhong; Wang, Biao","Nearly 100% internal phosphorescence efficiency in a polymer light-emitting diode using a new iridium complex phosphor","Journal of Materials Chemistry","2008","18","14","1636","","10.1039/b800977e","","","0.71073","MoKα","","0.0608","0.0319","","","0.0707","0.084","","","","","","1.055","","","","has coordinates","180350","2020-10-21","18:00:00",""
"7201966","5.916","0.01","7.78","0.01","18.02","0.02","85.34","0.05","98.25","0.06","93.72","0.06","817","2","93.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C24 H14 S2 -","- C24 H12 S2 -","- C48 H24 S4 -","2","1","","Mamada, Masashi; Nishida, Jun-ichi; Kumaki, Daisuke; Tokito, Shizuo; Yamashita, Yoshiro","High performance organic field-effect transistors based on [2,2′]bi[naphtho[2,3-b]thiophenyl] with a simple structure","Journal of Materials Chemistry","2008","18","29","3442","","10.1039/b801425f","","","0.7107","MoKα","","","0.0511","","","","0.1427","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202021","25.5883","0.0013","14.0036","0.0007","33.5098","0.0017","90","","107.722","0.001","90","","11437.7","1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C73 H169 Ag6 Cl3 N6 P12 S12 -","- C73 H169 Ag6 Cl3 N6 P12 S12 -","- C292 H676 Ag24 Cl12 N24 P48 S48 -","4","1","","Panneerselvam, Arunkumar; Malik, Mohammad A.; O'Brien, Paul; Raftery, James","The CVD of silver sulfide and silver thin films from a homoleptic crystalline single-source precursor","Journal of Materials Chemistry","2008","18","27","3264","","10.1039/b802616e","","","0.71073","MoKα","","0.0709","0.0476","","","0.0676","0.0725","","","","","","0.986","","","","has coordinates","180351","2020-10-21","18:00:00",""
"7202074","17.034","0.005","10.422","0.002","24.427","0.008","90","","90","","90","","4336","2","203","2","203","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C58 H46 Si -","- C58 H46 Si -","- C232 H184 Si4 -","4","0.5","","Zhan, Xiaowei; Haldi, Andreas; Risko, Chad; Chan, Calvin K.; Zhao, Wei; Timofeeva, Tatiana V.; Korlyukov, Aleksander; Antipin, Mikhail Yu.; Montgomery, Sarah; Thompson, Evans; An, Zesheng; Domercq, Benoit; Barlow, Stephen; Kahn, Antoine; Kippelen, Bernard; Brédas, Jean-Luc; Marder, Seth R.","Fluorenyl-substituted silole molecules: geometric, electronic, optical, and device properties","Journal of Materials Chemistry","2008","18","26","3157","","10.1039/b803470b","","","0.71073","MoKα","","0.1929","0.0623","","","0.1229","0.1409","","","","","","0.937","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202075","13.448","0.004","10.218","0.002","25.111","0.006","90","","97.34","0.02","90","","3422.3","1.5","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C47 H34 Si -","- C47 H34 Si -","- C188 H136 Si4 -","4","1","","Zhan, Xiaowei; Haldi, Andreas; Risko, Chad; Chan, Calvin K.; Zhao, Wei; Timofeeva, Tatiana V.; Korlyukov, Aleksander; Antipin, Mikhail Yu.; Montgomery, Sarah; Thompson, Evans; An, Zesheng; Domercq, Benoit; Barlow, Stephen; Kahn, Antoine; Kippelen, Bernard; Brédas, Jean-Luc; Marder, Seth R.","Fluorenyl-substituted silole molecules: geometric, electronic, optical, and device properties","Journal of Materials Chemistry","2008","18","26","3157","","10.1039/b803470b","","","0.71073","MoKα","","0.0683","0.0416","","","0.095","0.0998","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202097","8.76","0.0018","13.344","0.003","13.754","0.003","90","","90","","90","","1607.8","0.6","193","2","193","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H14 B2 Cl6 N2 Si2 -","- C4 H14 B2 Cl6 N2 Si2 -","- C16 H56 B8 Cl24 N8 Si8 -","4","0.5","","Müller, Utz; Weinmann, Markus; Jansen, Martin","Cl2MeSi‒NH‒BCl2 and ClMe2Si‒NH‒BCl2: novel processable single source precursors of amorphous Si/C/B/N ceramics","Journal of Materials Chemistry","2008","18","31","3671","","10.1039/b803899f","","","0.71073","MoKα","","0.0447","0.0436","","","0.1037","0.1072","","","","","","1.276","","","","has coordinates","180351","2020-10-21","18:00:00",""
"7202102","6.4194","0.0013","8.268","0.0017","15.213","0.003","90","","92.69","0.03","90","","806.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 N4 O4 -","- C18 H14 N4 O4 -","- C36 H28 N8 O8 -","2","0.5","","Qu, Songnan; Chen, Xiaofang; Shao, Xiang; Li, Fan; Zhang, Hongyu; Wang, Haitao; Zhang, Peng; Yu, Zhixin; Wu, Kai; Wang, Yue; Li, Min","Self-assembly of highly luminescent bi-1,3,4-oxadiazole derivatives through electron donor‒acceptor interactions in three-dimensional crystals, two-dimensional layers and mesophases","Journal of Materials Chemistry","2008","18","33","3954","","10.1039/b804189j","","","0.71073","MoKα","","0.058","0.0368","","","0.0916","0.0983","","","","","","1.087","","","","has coordinates","180352","2020-10-21","18:00:00",""
"7202144","26.1732","0.0002","15.7673","0.0002","18.1899","0.0002","90","","117.832","0.001","90","","6638.26","0.14","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H21 Cl2 F6 Ir N6 -","- C36 H21 Cl2 F6 Ir N6 -","- C288 H168 Cl16 F48 Ir8 N48 -","8","1","","Orselli, Enrico; Albuquerque, Rodrigo Q.; Fransen, P. Michel; Fröhlich, Roland; Janssen, Henk M.; De Cola, Luisa","1,2,3-Triazolyl-pyridine derivatives as chelating ligands for blue iridium(iii) complexes. Photophysics and electroluminescent devices","Journal of Materials Chemistry","2008","18","38","4579","","10.1039/b805324c","","","0.71073","MoKα","","0.0453","0.0338","","","0.0839","0.0886","","","","","","1.045","","","","has coordinates,has disorder","180352","2020-10-21","18:00:00",""
"7202145","25.9847","0.0002","16.2224","0.0002","18.3429","0.0002","90","","116.537","0.001","90","","6917.55","0.14","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C39 H24 F9 Ir N6 O -","- C39 H24 F9 Ir N6 O -","- C312 H192 F72 Ir8 N48 O8 -","8","1","","Orselli, Enrico; Albuquerque, Rodrigo Q.; Fransen, P. Michel; Fröhlich, Roland; Janssen, Henk M.; De Cola, Luisa","1,2,3-Triazolyl-pyridine derivatives as chelating ligands for blue iridium(iii) complexes. Photophysics and electroluminescent devices","Journal of Materials Chemistry","2008","18","38","4579","","10.1039/b805324c","","","0.71073","MoKα","","0.0388","0.0263","","","0.0571","0.061","","","","","","1.051","","","","has coordinates","180352","2020-10-21","18:00:00",""
"7202174","15.3491","0.001","15.7065","0.001","15.7888","0.001","66.033","0.001","61.608","0.001","62.436","0.001","2882.6","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C78.5 H49 Cl -","- C78.5 H49 Cl -","- C157 H98 Cl2 -","2","1","","Wang, Lei; Wong, Wai-Yeung; Lin, Mei-Fang; Wong, Wai-Kwok; Cheah, Kok-Wai; Tam, Hoi-Lam; Chen, Chin H.","Novel host materials for single-component white organic light-emitting diodes based on 9-naphthylanthracene derivatives","Journal of Materials Chemistry","2008","18","38","4529","","10.1039/b806183a","","","0.71073","MoKα","","0.1315","0.0932","","","0.2521","0.2973","","","","","","0.979","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202178","4.20533","0.00004","4.20533","","4.20533","","90","","90","","90","","74.3704","0.0007","295","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba0.97334 O2.931 Y0.1 Zr0.915 -","- Ba0.97334 O2.931 Y0.1 Zr0.915 -","","","","Azad, Abul K.; Savaniu, Cristian; Tao, Shanwen; Duval, Sophie; Holtappels, Peter; Ibberson, Richard M.; Irvine, John T. S.","Structural origins of the differing grain conductivity values in BaZr0.9Y0.1O2.95 and indication of novel approach to counter defect association","Journal of Materials Chemistry","2008","18","29","3414","","10.1039/b806190d","powder diffraction","","","","","","","","","","","","","1.07","","","","","","","has coordinates","180352","2020-10-21","18:00:00",""
"7202179","4.19943","0.000014","4.19943","","4.19943","","90","","90","","90","","74.0578","0.0002","295","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Ba O2.68 Y0.1 Zr0.9 -","- Ba O2.6796 Y0.1 Zr0.9 -","- Ba O2.6796 Y0.1 Zr0.9 -","1","0.0208333","","Azad, Abul K.; Savaniu, Cristian; Tao, Shanwen; Duval, Sophie; Holtappels, Peter; Ibberson, Richard M.; Irvine, John T. S.","Structural origins of the differing grain conductivity values in BaZr0.9Y0.1O2.95 and indication of novel approach to counter defect association","Journal of Materials Chemistry","2008","18","29","3414","","10.1039/b806190d","powder diffraction","","","","","","","","","","","","","1.26","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202196","12.042","0.003","12.306","0.003","11.691","0.004","95.75","0.03","111.52","0.02","83.2","0.02","1597.3","0.8","294.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H38 N2 O5 P S -","- C34 H38 N2 O5 P S -","- C68 H76 N4 O10 P2 S2 -","2","1","","Akutsu, Hiroki; Sato, Keiko; Yamashita, Shinji; Yamada, Jun-ichi; Nakatsuji, Shin'ichi; Turner, Scott S.","The first organic paramagnetic metal containing the aminoxyl radical","Journal of Materials Chemistry","2008","18","28","3313","","10.1039/b806694a","","","0.71069","MoKα","","","0.0516","","","","0.0597","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202197","12.436","0.004","19.528","0.006","9.326","0.003","97.06","0.03","110.22","0.03","83.44","0.03","2102.9","1.2","295.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H34 N2 O5 S17 -","- C30 H34 N2 O5 S17 -","- C60 H68 N4 O10 S34 -","2","1","","Akutsu, Hiroki; Sato, Keiko; Yamashita, Shinji; Yamada, Jun-ichi; Nakatsuji, Shin'ichi; Turner, Scott S.","The first organic paramagnetic metal containing the aminoxyl radical","Journal of Materials Chemistry","2008","18","28","3313","","10.1039/b806694a","","","0.71069","MoKα","","","0.0633","","","","0.0676","","","","","","1.134","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202225","7.6566","0.0007","14.2184","0.0013","12.4639","0.0011","90","","91.546","0.002","90","","1356.4","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","KP23","","","- C15 H20 O Zr -","- C15 H20 O Zr -","- C60 H80 O4 Zr4 -","4","1","","Black, Kate; Aspinall, Helen C.; Jones, Anthony C.; Przybylak, Katarzyna; Bacsa, John; Chalker, Paul R.; Taylor, Stephen; Zhao, Ce Zhou; Elliott, Simon D.; Zydor, Aleksandra; Heys, Peter N.","Deposition of ZrO2 and HfO2 thin films by liquid injection MOCVD and ALD using ansa-metallocene zirconium and hafnium precursors","Journal of Materials Chemistry","2008","18","38","4561","","10.1039/b807205a","","","0.71073","MoKα","","0.0208","0.019","","","0.0486","0.0496","","","","","","1.064","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202226","7.17","0.0014","9.053","0.0018","10.385","0.002","90","","91.14","0.03","90","","674","0.2","211","2","211","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","KP24","","","- C15 H20 Hf -","- C15 H20 Hf -","- C30 H40 Hf2 -","2","0.5","","Black, Kate; Aspinall, Helen C.; Jones, Anthony C.; Przybylak, Katarzyna; Bacsa, John; Chalker, Paul R.; Taylor, Stephen; Zhao, Ce Zhou; Elliott, Simon D.; Zydor, Aleksandra; Heys, Peter N.","Deposition of ZrO2 and HfO2 thin films by liquid injection MOCVD and ALD using ansa-metallocene zirconium and hafnium precursors","Journal of Materials Chemistry","2008","18","38","4561","","10.1039/b807205a","","","0.71073","MoKα","","0.0305","0.0255","","","0.0594","0.0602","","","","","","0.998","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202282","4.7896","0.001","23.389","0.005","11.493","0.002","90","","97.35","0.03","90","","1276.9","0.4","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H9 N3 S2 -","- C16 H9 N3 S2 -","- C64 H36 N12 S8 -","4","1","","Hong, Wei; Wei, Zhongming; Xi, Hongxia; Xu, Wei; Hu, Wenping; Wang, Quanrui; Zhu, Daoben","6H-Pyrrolo[3,2-b:4,5-b′]bis[1,4]benzothiazines: facilely synthesized semiconductors for organic field-effect transistors","Journal of Materials Chemistry","2008","18","40","4814","","10.1039/b809486a","","","0.71073","MoKα","","0.0926","0.0668","","","0.137","0.1503","","","","","","1.128","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202384","9.3669","0.0019","10.531","0.002","6.8081","0.0014","90","","90.42","0.03","90","","671.6","0.2","200","2","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N,N-Bis(1H-tetrazol-5-yl)amine monohydrate","N,N-Bis(1H-tetrazol-5-yl)amine monohydrate","","- C2 H5 N9 O -","- C2 H5 N9 O -","- C8 H20 N36 O4 -","4","1","","Klapötke, Thomas M.; Mayer, Peter; Stierstorfer, Jörg; Weigand, Jan J.","Bistetrazolylamines—synthesis and characterization","Journal of Materials Chemistry","2008","18","43","5248","","10.1039/b811273h","","","0.71073","MoKα","","0.0464","0.0367","","","0.0935","0.0998","","","","","","1.079","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202385","15.933","0.0014","6.8863","0.0006","19.9204","0.0015","90","","104.227","0.007","90","","2118.6","0.3","200","2","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","5,5-Bis(1H-tetrazolyl)amine monoydrate dimethylsulfoxid","5,5-Bis(1H-tetrazolyl)amine monoydrate dimethylsulfoxid","","- C4 H11 N9 O2 S -","- C4 H11 N9 O2 S -","- C32 H88 N72 O16 S8 -","8","1","","Klapötke, Thomas M.; Mayer, Peter; Stierstorfer, Jörg; Weigand, Jan J.","Bistetrazolylamines—synthesis and characterization","Journal of Materials Chemistry","2008","18","43","5248","","10.1039/b811273h","","","0.71073","MoKα","","0.0439","0.0406","","","0.1035","0.1067","","","","","","1.114","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202386","3.852","0.0012","19.395","0.005","5.769","0.0018","90","","95.6","0.03","90","","428.9","0.2","200","2","200","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","5,5-Bis(2-methyltetrazolyl)methylamine","5,5-Bis(2-methyltetrazolyl)methylamine","","- C5 H9 N9 -","- C5 H9 N9 -","- C10 H18 N18 -","2","0.5","","Klapötke, Thomas M.; Mayer, Peter; Stierstorfer, Jörg; Weigand, Jan J.","Bistetrazolylamines—synthesis and characterization","Journal of Materials Chemistry","2008","18","43","5248","","10.1039/b811273h","","","0.71073","MoKα","","0.0714","0.057","","","0.1252","0.1353","","","","","","1.176","","","","has coordinates","180354","2020-10-21","18:00:00",""
"7202387","10.279","0.002","11.338","0.002","6.772","0.0014","90","","94.74","0.03","90","","786.5","0.3","200","2","200","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Bis-(2-methyl-tetrazolyl)amine","Bis-(2-methyl-tetrazolyl)amine","","- C4 H7 N9 -","- C4 H7 N9 -","- C16 H28 N36 -","4","1","","Klapötke, Thomas M.; Mayer, Peter; Stierstorfer, Jörg; Weigand, Jan J.","Bistetrazolylamines—synthesis and characterization","Journal of Materials Chemistry","2008","18","43","5248","","10.1039/b811273h","","","0.71073","MoKα","","0.0573","0.0407","","","0.1096","0.1171","","","","","","1.139","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202388","11.109","0.002","9.2272","0.0018","21.327","0.004","90","","90","","90","","2186.1","0.7","200","2","200","","","","","","","","","3","P b c a","-P 2ac 2ab","61","N,N-Bis(1H-tetrazol-5-yl)amine","N,N-Bis(1H-tetrazol-5-yl)amine","","- C2 H3 N9 -","- C2 H3 N9 -","- C32 H48 N144 -","16","2","","Klapötke, Thomas M.; Mayer, Peter; Stierstorfer, Jörg; Weigand, Jan J.","Bistetrazolylamines—synthesis and characterization","Journal of Materials Chemistry","2008","18","43","5248","","10.1039/b811273h","","","0.71073","MoKα","","0.0645","0.0396","","","0.091","0.1022","","","","","","1.064","","","","has coordinates","180354","2020-10-21","18:00:00",""
"7202399","5.6667","0.0006","9.4916","0.0011","15.9768","0.0018","90","","90","","90","","859.33","0.17","90","2","90","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","C2H8N5, CH2N5","","","- C3 H10 N10 -","- C3 H10 N10 -","- C12 H40 N40 -","4","1","","Tao, Guo-Hong; Guo, Yong; Joo, Young-Hyuk; Twamley, Brendan; Shreeve, Jean'ne M.","Energetic nitrogen-rich salts and ionic liquids: 5-aminotetrazole (AT) as a weak acid","Journal of Materials Chemistry","2008","18","45","5524","","10.1039/b811506k","","","0.71073","MoKα","","0.0299","0.0291","","","0.0758","0.0767","","","","","","1.073","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202472","17.432","0.006","18.687","0.006","21.199","0.007","83.439","0.007","66.224","0.007","89.876","0.006","6271","4","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C70 H88 S3 -","- C70 H88 S3 -","- C280 H352 S12 -","4","2","","Mathieu Surin; Prashant Sonar; Andrew C. Grimsdale; Klaus Müllen; Steven De Feyter; Satoshi Habuchi; Stefano Sarzi; Els Braeken; An Ver Heyen; Mark Van der Auweraer; Frans C. De Schryver; Massimiliano Cavallini; Jean-François Moulin; Fabio Biscarini; Cristina Femoni; Roberto Lazzaroni; Philippe Leclère","Solid-state assemblies and optical properties of conjugated oligomers combining fluorene and thiophene units","Journal of Materials Chemistry","2007","17","8","728","","10.1039/b610132a","","","0.71073","MoKα","","0.2555","0.0858","","","0.1723","0.2265","","","","","","0.918","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202473","11.0586","0.0006","25.0054","0.0011","9.3633","0.0007","90","","108.299","0.002","90","","2458.3","0.3","296","2","","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C31 H30 N O -","- C31 H30 N O -","- C124 H120 N4 O4 -","4","1","","Oka, Hiroyuki; Kouno, Hiroshi; Tanaka, Hitoshi","Synthesis and through-bond spin interaction of stable 1,3-phenylene-linked polyradical carrying aminoxyls in the ?-conjugated main chain","Journal of Materials Chemistry","2007","17","12","1209","","10.1039/b610365k","","","1.54178","CuKα","","0.0494","0.0451","","","0.1087","0.1142","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202478","3.9826","0.0004","10.6","0.001","18.559","0.002","90","","91.327","0.005","90","","783.27","0.14","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 N2 O2 S2 -","- C18 H14 N2 O2 S2 -","- C36 H28 N4 O4 S4 -","2","0.5","","Ando, Shinji; Kumaki, Daisuke; Nishida, Jun-ichi; Tada, Hirokazu; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, physical properties and field-effect transistors of novel thiazolothiazole?phenylene co-oligomers","Journal of Materials Chemistry","2007","17","6","553","","10.1039/b611814c","","","0.7107","MoKα","","","0.0567","","","","0.1601","","","","","","1.832","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202479","3.744","0.004","6.07","0.007","15.84","0.02","91.8","0.05","96.94","0.05","84.68","0.04","355.7","0.7","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H4 F6 N2 S2 -","- C16 H4 F6 N2 S2 -","- C16 H4 F6 N2 S2 -","1","0.5","","Ando, Shinji; Kumaki, Daisuke; Nishida, Jun-ichi; Tada, Hirokazu; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, physical properties and field-effect transistors of novel thiazolothiazole?phenylene co-oligomers","Journal of Materials Chemistry","2007","17","6","553","","10.1039/b611814c","","","0.7107","MoKα","","","0.0306","","","","0.0794","","","","","","0.904","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202480","5.92","0.01","7.46","0.01","39.81","0.07","90","","91.24","0.08","90","","1758","5","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H14 N2 S2 -","- C24 H14 N2 S2 -","- C96 H56 N8 S8 -","4","1","","Ando, Shinji; Kumaki, Daisuke; Nishida, Jun-ichi; Tada, Hirokazu; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, physical properties and field-effect transistors of novel thiazolothiazole?phenylene co-oligomers","Journal of Materials Chemistry","2007","17","6","553","","10.1039/b611814c","","","0.7107","MoKα","","","0.1572","","","","0.4359","","","","","","1.58","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202481","38.84","0.03","7.001","0.005","13.023","0.009","90","","105.84","0.03","90","","3407","4","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Cl2 Fe0.5 O S6 -","- C13 H6 Cl2 Fe0.5 O S6 -","- C104 H48 Cl16 Fe4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.06","","","","0.064","","","","","","1.14","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202482","38.916","0.009","6.9981","0.0013","13.017","0.003","90","","105.893","0.002","90","","3409.5","1.3","293.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Cl2 Ga0.5 O S6 -","- C13 H6 Cl2 Ga0.5 O S6 -","- C104 H48 Cl16 Ga4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.056","","","","0.046","","","","","","1.156","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202483","39.69","0.04","7.01","0.01","13.14","0.02","90","","105.27","0.04","90","","3527","8","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Br2 Fe0.5 O S6 -","- C13 H6 Br2 Fe0.5 O S6 -","- C104 H48 Br16 Fe4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.045","","","","0.05","","","","","","0.804","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202484","39.48","0.002","6.9985","0.0003","13.1181","0.0008","90","","105.114","0.003","90","","3499.2","0.3","293.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Br2 Ga0.5 O S6 -","- C13 H6 Br2 Ga0.5 O S6 -","- C104 H48 Br16 Ga4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.076","","","","0.073","","","","","","1.079","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202485","13","0.02","6.908","0.008","20.11","0.03","99.86","0.05","105.13","0.03","89.97","0.06","1716","4","90","","","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H12 Br4 Fe O2 S12 -","- C26 H12 Br4 Fe O2 S12 -","- C52 H24 Br8 Fe2 O4 S24 -","2","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.048","","","","0.061","","","","","","1.033","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202486","21.5093","0.0005","29.6734","0.0008","36.0736","0.0009","90","","90","","90","","23024.1","1","290","2","290","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0573","0.0363","","","0.0979","0.1181","","","","","","1.055","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202487","21.4775","0.0005","29.6112","0.0007","36.0527","0.0009","90","","90","","90","","22928.6","1","270","2","270","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0527","0.0344","","","0.0924","0.1104","","","","","","1.067","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202488","21.4468","0.0005","29.5529","0.0007","36.0359","0.0009","90","","90","","90","","22840.1","0.9","250","2","250","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0492","0.0327","","","0.0878","0.1045","","","","","","1.076","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202489","21.4191","0.0005","29.4937","0.0007","36.0191","0.0009","90","","90","","90","","22754.3","0.9","230","2","230","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0456","0.0318","","","0.0848","0.0996","","","","","","1.075","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202490","21.3887","0.0006","29.4302","0.0008","35.989","0.001","90","","90","","90","","22654.1","1.1","210","2","210","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0418","0.0302","","","0.0809","0.0938","","","","","","1.067","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202491","21.3664","0.0007","29.3735","0.0009","35.975","0.0012","90","","90","","90","","22578.1","1.3","190","2","190","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0396","0.0296","","","0.0787","0.0902","","","","","","1.077","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202492","21.3434","0.0006","29.3178","0.0009","35.9441","0.0011","90","","90","","90","","22491.7","1.2","170","2","170","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0379","0.0292","","","0.073","0.0786","","","","","","1.074","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202493","23.1539","0.0007","21.3296","0.0007","23.1371","0.0008","90","","101.546","0.001","90","","11195.3","0.6","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0369","0.0309","","","0.0791","0.0879","","","","","","1.063","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202494","23.0935","0.0008","21.3176","0.0007","23.0731","0.0008","90","","101.442","0.001","90","","11133.1","0.7","130","2","130","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0382","0.0335","","","0.0863","0.0925","","","","","","1.041","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202495","23.0402","0.0008","21.3055","0.0007","23.011","0.0008","90","","101.31","0.001","90","","11076.4","0.7","110","2","110","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0324","0.029","","","0.0751","0.081","","","","","","1.044","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202496","22.9943","0.001","21.2963","0.0009","22.9549","0.0011","90","","101.218","0.002","90","","11026.1","0.9","90","2","90","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0298","0.027","","","0.071","0.0772","","","","","","1.043","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202497","22.9383","0.0011","21.2836","0.001","22.9242","0.0012","90","","101.227","0.002","90","","10977.6","0.9","70","2","70","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0448","0.0406","","","0.1082","0.1132","","","","","","1.042","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202498","22.9096","0.0011","21.2711","0.001","22.8969","0.0012","90","","101.206","0.002","90","","10945.2","0.9","50","2","50","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0439","0.0403","","","0.1077","0.1122","","","","","","1.053","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202499","22.8945","0.0011","21.2571","0.001","22.8707","0.0012","90","","101.148","0.002","90","","10920.5","0.9","30","2","30","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0437","0.0408","","","0.1096","0.1122","","","","","","1.041","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202500","22.845","0.008","21.263","0.007","22.907","0.008","90","","101.04","0.02","90","","10921","7","25","1","25","1","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0431","0.0424","","","0.1124","0.1135","","","","","","1.035","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202501","22.797","0.014","21.216","0.012","22.754","0.013","90","","100.51","0.03","90","","10821","11","12","1","12","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0384","0.0381","","","0.0988","0.0992","","","","","","1.131","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202502","11.91","0.02","13.05","0.02","18.42","0.04","94.85","0.06","97.12","0.06","94.57","0.06","2819","9","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H31 Ir N2 O2 -","- C35 H31 Ir N2 O2 -","- C140 H124 Ir4 N8 O8 -","4","2","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0273","","","","0.0899","","","","","","0.893","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202503","13.73","0.02","14","0.02","16.84","0.03","101.66","0.06","101.76","0.06","103.76","0.06","2969","8","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C37 H35 Ir N2 O2 -","- C37 H35 Ir N2 O2 -","- C148 H140 Ir4 N8 O8 -","4","2","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0324","","","","0.1167","","","","","","1.107","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202504","14.04","0.02","14.11","0.02","17.34","0.02","101.53","0.06","103.15","0.06","102.54","0.05","3151","7","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C39 H39 Ir N2 O2 -","- C39 H39 Ir N2 O2 -","- C156 H156 Ir4 N8 O8 -","4","2","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0227","","","","0.0761","","","","","","0.914","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202505","9.89","0.01","11.24","0.01","11.79","0.01","68.15","0.03","87.5","0.04","70.81","0.03","1144.2","1.9","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H31 Ir N2 O2 -","- C27 H31 Ir N2 O2 -","- C54 H62 Ir2 N4 O4 -","2","1","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0205","","","","0.0513","","","","","","0.804","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202506","15.87","0.02","20.7","0.02","24.37","0.03","90","","90","","90","","8006","16","93.2","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C49 H43 Cl3 Ir N3 -","- C49 H43 Cl3 Ir N3 -","- C392 H344 Cl24 Ir8 N24 -","8","1","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0218","","","","0.0479","","","","","","0.8","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202507","11.09","0.01","12.19","0.02","13.86","0.02","82.93","0.05","78.73","0.04","88.53","0.05","1824","4","93.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C48 H42 Ir N3 -","- C48 H36 Ir N3 -","- C96 H72 Ir2 N6 -","2","1","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0255","","","","0.0747","","","","","","0.918","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202508","9.541","0.001","9.541","0.001","5.266","0.001","90","","90","","120","","415.14","0.1","293","2","293","2","","","","","","","synthesis as described","3","P 63","P 6c","173","alpha indium iodate","","","- I3 In O9 -","- I3 In O9 -","- I6 In2 O18 -","2","0.333333","","Phanon, Delphine; Mosset, Alain; Gautier-Luneau, Isabelle","New materials for infrared non-linear optics. Syntheses, structural characterisations, second harmonic generation and optical transparency of M(IO3)3 metallic iodates","Journal of Materials Chemistry","2007","17","11","1123","","10.1039/b612677d","","x-ray","0.56085","AgKa","","0.0275","0.0226","","","0.038","0.0391","","","","","","1.129","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202509","9.753","0.001","9.753","0.001","14.174","0.001","90","","90","","120","","1167.61","0.19","293","2","293","2","","","","","","","synthesis as described","3","R -3 :H","-R 3","148","beta indium iodate","","","- I3 In O9 -","- I3 In O9 -","- I18 In6 O54 -","6","0.333333","","Phanon, Delphine; Mosset, Alain; Gautier-Luneau, Isabelle","New materials for infrared non-linear optics. Syntheses, structural characterisations, second harmonic generation and optical transparency of M(IO3)3 metallic iodates","Journal of Materials Chemistry","2007","17","11","1123","","10.1039/b612677d","","x-ray","0.56085","AgKa","","0.0271","0.0229","","","0.0455","0.0468","","","","","","1.216","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202514","10.10786","0.00005","10.10786","","10.10786","","90","","90","","90","","1032.71","0.005","2","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","from C:/Gsas/Bob/pyro/Osmates/D2B/2K/2K.EXP","","","- O6 Os2 Rb -","- O6 Os2 Rb -","- O48 Os16 Rb8 -","8","0.0416667","","Galati, Rosa; Hughes, Robert W.; Knee, Christopher S.; Henry, Paul F.; Weller, Mark T.","The structure of superconducting RbOs2O6 between 2 K and 300 K","Journal of Materials Chemistry","2007","17","2","160","","10.1039/b613083f","powder diffraction","","","","","","","","","","","","","1","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202515","10.11393","0.00005","10.11393","","10.11393","","90","","90","","90","","1034.57","0.005","300","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","300K Fd3M","","","- O6 Os2 Rb -","- O6 Os2 Rb -","- O48 Os16 Rb8 -","8","0.0416667","","Galati, Rosa; Hughes, Robert W.; Knee, Christopher S.; Henry, Paul F.; Weller, Mark T.","The structure of superconducting RbOs2O6 between 2 K and 300 K","Journal of Materials Chemistry","2007","17","2","160","","10.1039/b613083f","powder diffraction","","","","","","","","","","","","","1.09","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202524","3.8496","0.0011","41.04","0.011","11.262","0.003","90","","95.59","0.004","90","","1770.8","0.8","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 N2 S5 -","- C20 H10 N2 S5 -","- C80 H40 N8 S20 -","4","1","","Berridge, Rory; Wright, Shaun P.; Skabara, Peter J.; Dyer, Aubrey; Steckler, Tim; Argun, Avni A.; Reynolds, John R.; Harrington, Ross W.; Clegg, William","Electrochromic properties of a fast switching, dual colour polythiophene bearing non-planar dithiinoquinoxaline units","Journal of Materials Chemistry","2007","17","3","225","","10.1039/b613879a","","","0.6896","synchrotron","","0.1155","0.09","","","0.1606","0.1683","","","","","","1.261","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202527","5.428","0.0019","5.4261","0.0018","16.6564","0.0017","90","","90","","90","","490.6","0.2","295","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Bi2NbO5F","","- Bi2 Nb O6 -","- Bi2 Nb O6 -","- Bi8 Nb4 O24 -","4","0.5","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202528","5.6059","0.0022","5.6059","","5.6059","","90","","90","","90","","176.17","0.07","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Bi2O3","","- Bi O1.5 -","- Bi O1.5 -","- Bi4 O6 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202529","5.7853","0.0023","5.7853","","5.7853","","90","","90","","90","","193.63","0.08","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","BiF3","","- Bi F3 -","- Bi F3 -","- Bi4 F12 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202530","5.427","0.0018","16.6584","0.0017","5.4282","0.0017","90","","90","","90","","490.7","0.2","295","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","Bi2NbO5F","","- Bi2 Nb O6 -","- Bi2 Nb O6 -","- Bi8 Nb4 O24 -","4","1","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202531","5.604","0.0021","5.604","","5.604","","90","","90","","90","","175.99","0.07","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Bi2O3","","- Bi O1.5 -","- Bi O1.5 -","- Bi4 O6 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202532","5.7832","0.0023","5.7832","","5.7832","","90","","90","","90","","193.42","0.08","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","BiF3","","- Bi F3 -","- Bi F3 -","- Bi4 F12 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202533","5.4358","0.0001","15.623","0.0004","5.6075","0.0001","90","","90","","90","","476.209","0.017","","","293","","","","","","","","","4","I m m a","-I 2b 2","74","","","","- Al1.07 Mn0.93 O5 Sr2 -","- Al1.07 Mn0.93 O5 Sr2 -","- Al4.28 Mn3.72 O20 Sr8 -","4","0.25","","Joke Hadermann; Artem M. Abakumov; Hans D'Hondt; Anna S. Kalyuzhnaya; Marina G. Rozova; Maria M. Markina; Mikhail G. Mikheev; Natalia Tristan; Rüdiger Klingeler; Bernd Büchner; Evgeny V. Antipov","Synthesis and crystal structure of the Sr2Al1.07Mn0.93O5 brownmillerite","Journal of Materials Chemistry","2007","17","7","692","","10.1039/b614168d","powder diffraction","","1.5406","X-ray","","0.037","0.0356","","","0.0213","0.0213","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202534","6.0627","0.0008","10.7122","0.0015","10.3872","0.0014","90","","97.956","0.002","90","","668.1","0.16","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Manganese oxalate-phosphite","","","- C3 H7 Mn N O5 P -","- C3 H7 Mn N O5 P -","- C12 H28 Mn4 N4 O20 P4 -","4","1","","Mandal, Sukhendu; Green, Mark A.; Pati, Swapan K.; Natarajan, Srinivasan","Synthesis, structure and magnetic properties of an inorganic?organic hybrid compound","Journal of Materials Chemistry","2007","17","10","980","","10.1039/b614186b","","","0.71073","MoKα","","0.0259","0.0247","","","0.0693","0.0699","","","","","","1.073","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202535","8.09","0.02","18.71","0.02","10.16","0.08","90","","90.091","0.019","90","","1538","13","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17 N -","- C20 H17 N -","- C80 H68 N4 -","4","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.0717","0.0469","","","0.1133","0.1256","","","","","","1.094","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202536","14.178","0.006","14.05","0.03","15.909","0.005","90","","93.62","0.03","90","","3163","7","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H15 N S -","- C20 H15 N S -","- C160 H120 N8 S8 -","8","2","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.0687","0.0568","","","0.1631","0.1734","","","","","","1.061","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202537","16.19","0.04","7.739","0.01","23.46","0.03","90","","90","","90","","2939","9","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C20 H15 N -","- C20 H15 N -","- C160 H120 N8 -","8","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.0562","0.0372","","","0.0919","0.1001","","","","","","1.082","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202538","8.616","0.01","9.832","0.01","38.95","0.07","90","","90","","90","","3300","8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C44 H31 N3 -","- C44 H31 N3 -","- C176 H124 N12 -","4","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.046","0.0378","","","0.0928","0.0989","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202539","10.985","0.004","24.813","0.008","13.194","0.004","90","","110.149","0.007","90","","3376.2","1.9","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H31 N3 S2 -","- C44 H31 N3 S2 -","- C176 H124 N12 S8 -","4","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71073","MoKα","","0.3273","0.0609","","","0.111","0.1842","","","","","","0.611","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202540","3.89827","0.00002","3.89827","0.00002","7.8002","0.0001","90","","90","","90","","118.536","0.0017","973","","973","","","","","","","","","4","P 4/m m m","-P 4 2","123","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.5665 O3 Ti -","- La1.133 O6 Ti2 -","2","0.125","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flightneutronbeam","","","","","","","","","8.8179","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202541","5.48162","0.00001","5.48162","0.00001","7.74646","0.00001","90","","90","","90","","232.767","0.0007","295","","295","","","","","","","","","4","P 4/n b m","-P 4a 2b","125","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.5675 Li0.3 O3 Ti -","- La2.27 Li1.2 O12 Ti4 -","4","","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flight","","","","","","","","","2.6501","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202542","5.49921","0.00001","5.49921","0.00001","7.77237","0.00001","90","","90","","90","","235.047","0.0007","673","","673","","","","","","","","","4","P 4/n b m","-P 4a 2b","125","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.567 Li0.3 O3 Ti -","- La2.268 Li1.2 O12 Ti4 -","4","","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flightneutronbeam","","","","","","","","","8.0825","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202543","5.50511","0.00001","5.50511","0.00001","7.78545","0.00001","90","","90","","90","","235.948","0.0007","823","","823","","","","","","","","","4","P 4/n b m","-P 4a 2b","125","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.567 Li0.3 O3 Ti -","- La2.268 Li1.2 O12 Ti4 -","4","","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flightneutronbeam","","","","","","","","","3.8606","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202572","9.725","","9.725","","7.189","","90","","90","","120","","588.814","","","","300","","","","","","","","","3","P 63","P 6c","173","apatite","","","- La8.898 O25.96 Si6 -","- La8.898 O25.9602 Si6 -","- La8.898 O25.9602 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0179","0.0281","","","0.0283","0.0228","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202573","9.74","","9.74","","7.267","","90","","90","","120","","597.04","","","","","","","","","","","","","4","P 63","P 6c","173","Ba doped apatite","","","- Ba1.076 La8.924 O25.869 Si6 -","- La10 O25.87 Si6 -","- La10 O25.87 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0173","0.0161","","","0.0138","0.0225","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202574","9.705","","9.705","","7.215","","90","","90","","120","","588.516","","","","","","","","","","","","","4","P 63","P 6c","173","Sr doped apatite","","","- La8.898 O25.886 Si6 Sr -","- La9.9 O25.886 Si6 -","- La9.9 O25.886 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0173","0.0182","","","0.017","0.0218","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202575","9.68","","9.68","","7.161","","90","","90","","120","","581.106","","","","","","","","","","","","","4","P 63","P 6c","173","Ca doped apatite","","","- Ca1.258 La8.742 O25.879 Si6 -","- La10 O25.878 Si6 -","- La10 O25.878 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0175","0.0133","","","0.0141","0.0226","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202576","17.039","0.005","18.642","0.008","13.69","0.004","90","","90","","90","","4349","3","293","2","293","2","","","","","","","Synthesized by the authors. See text","5","P b c n","-P 2n 2ab","60","","","","- C20 H18 N2 O4 S3 -","- C20 H18 N2 O4 S3 -","- C160 H144 N16 O32 S24 -","8","1","","Marie Bourgeaux; Sergio Andrés Pérez Guarìn; W. G. Skene","Photophysical, crystallographic, and electrochemical characterization of novel conjugated thiopheno azomethines","Journal of Materials Chemistry","2007","17","10","972","","10.1039/b615325a","","","1.54178","CuKα","","0.1033","0.0397","","","0.0866","0.1019","","","","","","0.705","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202577","15.888","0.005","16.518","0.005","33.306","0.005","90","","90","","90","","8741","4","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C43 H49 O16 P2 -","- C43 H46 O16 P2 -","- C344 H368 O128 P16 -","8","1","","Daly, Susan M.; Grassi, Michele; Shenoy, Devanand K.; Ugozzoli, Franco; Dalcanale, Enrico","Supramolecular surface plasmon resonance (SPR) sensors for organophosphorus vapor detection","Journal of Materials Chemistry","2007","17","18","1809","","10.1039/b615516b","","","0.71069","MoKα","","0.1029","0.0971","","","0.3308","0.3328","","","","","","1.525","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202578","16.509","0.003","24.993","0.005","15.729","0.004","95.057","0.003","90.314","0.004","81.317","0.004","6390","2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C126 H182 O33 P4 -","- C126 H159 O33 P4 -","- C252 H318 O66 P8 -","2","1","","Daly, Susan M.; Grassi, Michele; Shenoy, Devanand K.; Ugozzoli, Franco; Dalcanale, Enrico","Supramolecular surface plasmon resonance (SPR) sensors for organophosphorus vapor detection","Journal of Materials Chemistry","2007","17","18","1809","","10.1039/b615516b","","","1.54184","CuKα","","0.1332","0.1066","","","0.3195","0.3598","","","","","","1.072","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202579","10.20109","0.00009","10.20109","0.00009","10.20109","0.00009","90","","90","","90","","1061.55","0.016","293","2","293","2","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","Dimercury(ii) Heptaoxodiruthenate(V)","Dimercury(II) Heptaoxodiruthenate(V)","","- Hg2 O7 Ru2 -","- Hg2 O7 Ru2 -","- Hg16 O56 Ru16 -","8","0.0416667","","Klein, Wilhelm; Kremer, Reinhard K.; Jansen, Martin","Hg2Ru2O7, a new pyrochlore showing a metal?insulator transition","Journal of Materials Chemistry","2007","17","14","1356","","10.1039/b615653c","","","0.71073","MoKα","","0.0283","0.0213","","","0.0483","0.0506","","","","","","1.429","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202587","10.0361","0.0001","11.1106","0.0001","14.0054","0.0001","96.0383","0.0007","90.759","0.0006","107.019","0.0005","1483.43","0.02","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C33.5 H18 Cl F10 Ir N4 -","- C33.5 H18 Cl F10 Ir N4 -","- C67 H36 Cl2 F20 Ir2 N8 -","2","1","","Shih, Ping-I; Chien, Chen-Han; Chuang, Chu-Ying; Shu, Ching-Fong; Yang, Cheng-Han; Chen, Jian-Hong; Chi, Yun","Novel host material for highly efficient blue phosphorescent OLEDs","Journal of Materials Chemistry","2007","17","17","1692","","10.1039/b616043c","","","0.71073","MoKα","","0.0314","0.0275","","","0.0653","0.0696","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202608","10.5863","0.0004","10.9741","0.0004","14.5969","0.0005","96.217","0.002","97.195","0.002","111.441","0.002","1544.06","0.1","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C28 H36 N4 O4 S3 -","- C28 H36 N4 O4 S3 -","- C56 H72 N8 O8 S6 -","2","1","","Stéphane Dufresne; Marie Bourgeaux; W. G. Skene","Tunable spectroscopic and electrochemical properties of conjugated push?push, push?pull and pull?pull thiopheno azomethines","Journal of Materials Chemistry","2007","17","12","1166","","10.1039/b616379c","","","1.54178","CuKα","","0.1354","0.1054","","","0.2912","0.3097","","","","","","1.192","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202610","12.6899","0.0013","18.2468","0.0018","18.7138","0.0018","68.885","0.001","88.916","0.002","71.552","0.001","3812.3","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","(MeB(3-(Mes)Pz)3)CuCl.CH2Cl2","","","- C38 H44 B Cl3 Cu N6 -","- C38 H44 B Cl3 Cu N6 -","- C152 H176 B4 Cl12 Cu4 N24 -","4","2","","Rasika Dias, H. V.; Gamini Rajapakse, R. M.; Milan Krishantha, D. M.; Fianchini, Mauro; Wang, Xiaoyu; Elsenbaumer, Ronald L.","Eco-friendly synthesis of high-quality polyaniline using a copper(ii) scorpionate catalyst","Journal of Materials Chemistry","2007","17","18","1762","","10.1039/b616816g","","","0.71073","MoKα","","0.1098","0.061","","","0.1289","0.1529","","","","","","0.993","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202611","31.232","0.002","35.725","0.002","20.2073","0.001","90","","121.196","0.002","90","","19286.3","1.9","93.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C192 H288 Ce N16 S16 -","- C192 H288 Ce N16 S16 -","- C768 H1152 Ce4 N64 S64 -","4","1","","Nekelson, Fabien; Monobe, Hirosato; Shiro, Motoo; Shimizu, Yo","Liquid crystalline and charge transport properties of double-decker cerium phthalocyanine complexes","Journal of Materials Chemistry","2007","17","25","2607","","10.1039/b616848p","","","0.71075","MoKα","","","0.0731","","","","0.2033","","","","","","1.057","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202627","18.337","0.008","37.6","0.02","14.259","0.008","90","","91.11","0.02","90","","9829","9","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C103.75 H105.25 N3 O14 -","- C94.704 H80.408 N3 O12.852 -","- C378.816 H321.632 N12 O51.408 -","4","0.5","","Lim, Young-Kwan; Jiang, Xuan; Bollinger, John C.; Lee, Dongwhan","Molecular engineering of two-dimensional ?-conjugation: expected and unexpected photophysical consequences of a simple particle-in-a-box approach","Journal of Materials Chemistry","2007","17","19","1969","","10.1039/b617353e","","","0.71073","MoKα","","0.1678","0.0968","","","0.2174","0.2539","","","","","","0.971","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202628","10.785","0.004","18.741","0.007","19.655","0.007","79.619","0.008","89.361","0.008","76.27","0.008","3794","2","129","2","129","2","","","","","","","","5","P -1","-P 1","2","","","","- C88.5 H80.25 Cl2.25 N3 O9 -","- C88.458 H80.215 Cl2.243 N3 O9 -","- C176.916 H160.43 Cl4.486 N6 O18 -","2","1","","Lim, Young-Kwan; Jiang, Xuan; Bollinger, John C.; Lee, Dongwhan","Molecular engineering of two-dimensional ?-conjugation: expected and unexpected photophysical consequences of a simple particle-in-a-box approach","Journal of Materials Chemistry","2007","17","19","1969","","10.1039/b617353e","","","0.71073","MoKα","","0.1586","0.0776","","","0.1701","0.2099","","","","","","1.081","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202631","21.761","0.01","15.819","0.007","17.876","0.008","90","","97.911","0.005","90","","6095","5","93.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H66 Cl2 Mn2 N12 Ni O14 -","- C60 H66 Cl2 Mn2 N12 Ni O14 -","- C240 H264 Cl8 Mn8 N48 Ni4 O56 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0709","","","","0.1725","","","","","","1.1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202632","21.848","0.006","16.041","0.004","18.444","0.005","90","","98.856","0.005","90","","6387","3","93.1","","","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C60 H66 F12 Mn2 N12 Ni O6 P2 -","- C60 H66 F12 Mn2 N12 Ni O6 P2 -","- C240 H264 F48 Mn8 N48 Ni4 O24 P8 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0507","","","","0.1066","","","","","","1.007","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202633","21.992","0.01","16.141","0.007","17.831","0.008","90","","98.103","0.005","90","","6266","5","93.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H70 Cl2 Mn2 N12 Ni O14 -","- C62 H70 Cl2 Mn2 N12 Ni O14 -","- C248 H280 Cl8 Mn8 N48 Ni4 O56 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0601","","","","0.1296","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202634","16.96","0.017","10.715","0.011","16.298","0.017","90","","107.737","0.013","90","","2821","5","93.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24.64 H28.64 Cl1.92 N8 Ni O4 -","- C25.22 H22 Cl1.94 N8 Ni O4 -","- C100.88 H88 Cl7.76 N32 Ni4 O16 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0625","","","","0.121","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202635","14.0604","0.0005","10.7206","0.0019","27.612","0.003","90","","90","","90","","4162.1","0.9","193","2","193","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C46 H42 N4 O12 -","- C46 H42 N4 O12 -","- C184 H168 N16 O48 -","4","1","","Seyler, Helga; Berger-Nicoletti, Elena; Kilbinger, Andreas F. M.","Rod?coil copolymers from oligo(p-benzamide) foldamers","Journal of Materials Chemistry","2007","17","19","1954","","10.1039/b617598h","","","1.54178","CuKα","","0.2332","0.0878","","","0.193","0.2513","","","","","","0.983","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202638","16.31134","0.00085","16.31134","0.00085","16.31134","0.00085","90","","90","","90","","4339.8","0.4","298","","298","","","","","","","","","6","P n -3 m :2","-P 4bc 2bc 3","224","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii) bisaquo","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii) bisaquo","","- C8 H8 F2 N4 O4 Pd -","- C12 H8 F2 N8 O6 Pd -","- C144 H96 F24 N96 O72 Pd12 -","12","0.25","","Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi; Conchi O. Ania; José B. Parra","Borderline microporous?ultramicroporous palladium(ii) coordination polymer networks. Effect of pore functionalisation on gas adsorption properties","Journal of Materials Chemistry","2007","17","19","1939","","10.1039/b617698d","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","1.712","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202639","16.29569","0.00084","16.29569","0.00084","16.29569","0.00084","90","","90","","90","","4327.3","0.4","400","","400","","","","","","","","","6","P n -3 m :2","-P 4bc 2bc 3","224","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii)","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii)","","- C8 H4 F2 N4 O2 Pd -","- C12 H8 F2 N8 O2 Pd -","- C144 H96 F24 N96 O24 Pd12 -","12","0.25","","Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi; Conchi O. Ania; José B. Parra","Borderline microporous?ultramicroporous palladium(ii) coordination polymer networks. Effect of pore functionalisation on gas adsorption properties","Journal of Materials Chemistry","2007","17","19","1939","","10.1039/b617698d","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","5.025","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202641","32.777","0.002","24.737","0.002","23.235","0.002","90","","111.181","0.003","90","","17566","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H147 Ag3 N12 O110 P2 W24 -","- C48 H101.4 Ag3 N12 O108.2 P2 W23.4 -","- C192 H405.6 Ag12 N48 O432.8 P8 W93.6 -","4","0.5","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.1121","0.058","","","0.1402","0.1787","","","","","","1.014","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202642","10.8053","0.0003","11.1381","0.0003","13.3396","0.0003","97.2","0.002","113.487","0.001","108.774","0.001","1333.3","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Compound ha003","","","- C16 H48 Ag4 Mo8 O34 S8 -","- C16 H48 Ag4 Mo8 O34 S8 -","- C16 H48 Ag4 Mo8 O34 S8 -","1","0.5","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.0307","0.0249","","","0.0575","0.06","","","","","","1.068","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202643","11.9401","0.0003","38.3746","0.001","12.8124","0.0003","90","","94.095","0.002","90","","5855.6","0.3","120","2","120","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","Compound ys16401d","","","- C24 H64 Ag3 Mn Mo6 N2 O32 S8 -","- C24 H64 Ag3 Mn Mo6 N2 O32 S8 -","- C96 H256 Ag12 Mn4 Mo24 N8 O128 S32 -","4","1","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.0759","0.0444","","","0.0843","0.0948","","","","","","1.029","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202644","11.984","0.004","37.696","0.01","13.122","0.004","90","","97.158","0.015","90","","5882","3","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H64 Ag3 Mn Mo6 N4 O31 S7 -","- C25.5 H46 Ag3 Mn Mo6 N4 O31 S6.65 -","- C102 H184 Ag12 Mn4 Mo24 N16 O124 S26.6 -","4","1","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.1297","0.0664","","","0.127","0.1531","","","","","","1.042","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202657","13.568","0.0009","14.907","0.001","24.0773","0.0018","76.898","0.003","74.505","0.002","77.736","0.002","4510.4","0.5","","","","","","","","","","","","3","P -1","-P 1","2","","","","?","- C114 H156 N4 -","- C114 H156 N4 -","","","","Sergio Andrés Pérez Guarìn; Stéphane Dufresne; Derek Tsang; Assa Sylla; W. G. Skene","Photophysical, electrochemical, and crystallographic investigation of conjugated fluoreno azomethines and their precursors","Journal of Materials Chemistry","2007","17","27","2801","","10.1039/b618098a","","","","","","","","","","","","","","","","","","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202658","8.5576","0.0006","9.1964","0.0007","10.2811","0.0007","79.739","0.001","74.878","0.001","65.164","0.001","706.68","0.09","293","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H15 N7 -","- C15 H15 N7 -","- C30 H30 N14 -","2","1","","Butler, Roslyn S.; Myers, Andrea K.; Bellarmine, Prabhu; Abboud, Khalil A.; Castellano, Ronald K.","Highly fluorescent donor?acceptor purines","Journal of Materials Chemistry","2007","17","19","1863","","10.1039/b618171f","","","0.71073","MoKα","","0.045","0.0383","","","0.1027","0.1065","","","","","","1.032","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202659","10.0863","0.0008","8.6914","0.0007","16.9812","0.0014","90","","98.137","0.002","90","","1473.7","0.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N7 -","- C15 H15 N7 -","- C60 H60 N28 -","4","1","","Butler, Roslyn S.; Myers, Andrea K.; Bellarmine, Prabhu; Abboud, Khalil A.; Castellano, Ronald K.","Highly fluorescent donor?acceptor purines","Journal of Materials Chemistry","2007","17","19","1863","","10.1039/b618171f","","","0.71073","MoKα","","0.0569","0.0475","","","0.12","0.1269","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202660","7.3178","0.0014","10.551","0.002","20.587","0.004","90","","90","","90","","1589.5","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 B N2 O2 -","- C15 H21 B N2 O2 -","- C60 H84 B4 N8 O8 -","4","1","","Tan, Wei; Zhang, Deqing; Wang, Zhuo; Liu, Caiming; Zhu, Daoben","4-(N,N-Dimethylamine)benzonitrile (DMABN) derivatives with boronic acid and boronate groups: new fluorescent sensors for saccharides and fluoride ion","Journal of Materials Chemistry","2007","17","19","1964","","10.1039/b618183j","","","0.71073","MoKα","","0.09","0.0701","","","0.157","0.1682","","","","","","1.094","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202675","10.3021","0.0004","20.0384","0.0011","35.1923","0.0009","90","","92.693","0.0007","90","","7257","0.5","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.43 H40 Fe N O13 S32 -","- C51.44 H37 Fe N O13 S32 -","- C205.76 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0851","","","","0.0613","","","","","","1.099","","","","has coordinates","275107","2022-05-06","15:04:04",""
"7202676","10.3031","0.001","20.0498","0.0007","35.1933","0.0007","90","","92.6869","0.0004","90","","7262.1","0.8","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.45 H40 Fe N O13 S32 -","- C51.46 H37 Fe N O13 S32 -","- C205.84 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0698","","","","0.0587","","","","","","1.073","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202677","10.3012","0.0003","20.08","0.0011","35.2191","0.0008","90","","92.6379","0.0004","90","","7277.3","0.5","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.67 H40 Fe N O13 S32 -","- C51.68 H37 Fe N O13 S32 -","- C206.72 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0726","","","","0.0612","","","","","","1.122","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202678","10.296","0.0008","20.064","0.003","35.1951","0.0008","90","","92.696","0.0005","90","","7262.5","1.2","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.76 H40 Fe N O13 S32 -","- C51.76 H37 Fe N O13 S32 -","- C207.04 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0788","","","","0.0731","","","","","","1.113","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202679","10.291","0.003","20.073","0.017","35.242","0.017","90","","92.641","0.016","90","","7272","7","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.86 H40 Fe N O13 S32 -","- C51.86 H37 Fe N O13 S32 -","- C207.44 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0518","","","","0.0608","","","","","","1.031","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202680","10.2904","0.001","20.09","0.003","35.207","0.003","90","","92.663","0.003","90","","7270.6","1.4","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52.08 H40 Fe N O13 S32 -","- C52.08 H37 Fe N O13 S32 -","- C208.32 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0798","","","","0.0606","","","","","","1.134","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202681","10.2911","0.0016","20.1062","0.0016","35.2174","0.0009","90","","92.6683","0.0006","90","","7279.1","1.3","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52.21 H40 Fe N O13 S32 -","- C52.22 H37 Fe N O13 S32 -","- C208.88 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0659","","","","0.0629","","","","","","1.056","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202682","10.2747","0.0009","20.1509","0.0013","35.2218","0.0008","90","","92.6684","0.0005","90","","7284.6","0.8","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52.81 H45 Fe N O12 S32 -","- C52.808 H37 Fe N O13 S32 -","- C211.232 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0467","","","","0.0552","","","","","","1.059","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202726","9.242","0.004","5.718","0.0011","18.205","0.006","90","","100.06","0.03","90","","947.3","0.6","300","","300","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","","- C24 H22 S2 -","- C24 H22 S2 -","- C48 H44 S4 -","2","0.5","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","0.71073","MoKα","","0.1888","0.0418","","0.1943","0.0826","0.1943","","","","","","0.9467","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202727","5.558","0.003","7.665","0.004","37.188","0.025","90","","90","","90","","1584.3","1.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","5,5'-bis(4-hydroxyphenyl)-2,2'-bithiophene","5,5'-bis(4-hydroxyphenyl)-2,2'-bithiophene","","- C20 H14 O2 S2 -","- C80 H56 O8 S8 -","- C80 H56 O8 S8 -","","","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","1.2084","synchrotron","","","","","","","","","","","","","","","","","has coordinates","277887","2022-09-15","15:15:13",""
"7202728","33.056","0.022","7.485","0.004","5.876","0.003","90","","96.16","0.03","90","","1445.5","1.4","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","5,5'-bis-4-(6-hydroxyhexyloxy)-phenyl-2,2'-bithiophene","5,5'-bis-4-(6-hydroxyhexyloxy)-phenyl-2,2'-bithiophene","","- C32 H38 O4 S2 -","- C64 H76 O8 S4 -","- C64 H76 O8 S4 -","","","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","1.2084","synchrotron","","","","","","","","","","","","","","","","","has coordinates","277887","2022-09-15","15:15:13",""
"7202729","9.109","0.002","5.7272","0.0007","18.159","0.004","90","","101.54","0.02","90","","928.2","0.3","120","","120","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","","- C24 H22 S2 -","- C24 H22 S2 -","- C48 H44 S4 -","2","0.5","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","0.71073","MoKα","","0.171","0.0824","","0.342","0.0505","0.0505","","","","","","1.0829","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202742","3.7587","0.0014","3.759","0.002","13.007","0.004","90","","90","0.05","90","","183.78","0.13","","","293","","","","","","","","","4","I 4/m m m","","","","","","- Cu La1.111 O3.506 Sr0.889 -","- Cu La1.1576 O3.4776 Sr0.8422 -","- Cu2 La2.3152 O6.9552 Sr1.6844 -","2","0.0625","","Joke Hadermann; Olivier Pérez; Nicolas Créon; Claude Michel; Maryvonne Hervieu","The (3 + 2)D structure of oxygen deficient LaSrCuO3.52","Journal of Materials Chemistry","2007","17","22","2344","","10.1039/b701449j","powder diffraction","neutron","1.225","neutron","","0.0368","0.0329","","","0.0355","0.0362","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202788","4.7566","0.0012","6.225","0.002","10.116","0.017","72.97","0.06","85.49","0.08","80.83","0.03","282.6","0.5","298","2","298","2","","","","","","","","4","P 1","P 1","1","","","","- C10 H12 N2 O3 -","- C10 H12 N2 O3 -","- C10 H12 N2 O3 -","1","1","","Erik Schwartz; Heather J. Kitto; René de Gelder; Roeland J. M. Nolte; Alan E. Rowan; Jeroen J. L. M. Cornelissen","Synthesis, characterisation and chiroptical properties of ?click?able polyisocyanopeptides","Journal of Materials Chemistry","2007","17","19","1876","","10.1039/b701922j","","","0.71073","MoKα","","0.1154","0.0698","","0.1591","0.1399","0.1591","","","1.026","","","1.026","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202822","12.6196","0.0018","17.378","0.002","26.551","0.004","90.019","0.01","98.764","0.011","92.938","0.01","5747","1.4","120","2","120","2","","","","","","","","6","P -1","-P 1","2","Dr. S. G. Carling/Dr. L. Martin","","","- C138 H120 Fe8 Na18 O120 S72 -","- C138 H120 Fe8 Na18 O120 S72 -","- C138 H120 Fe8 Na18 O120 S72 -","1","0.5","","Martin, Lee; Day, Peter; Clegg, William; Harrington, Ross W.; Horton, Peter N.; Bingham, Ann; Hursthouse, Michael B.; McMillan, Paul; Firth, Steven","Multi-layered molecular charge-transfer salts containing alkali metal ions","Journal of Materials Chemistry","2007","17","31","3324","","10.1039/b702442h","","","0.71073","MoKα","","0.2117","0.1026","","","0.1685","0.2079","","","","","","1.063","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202823","32.9933","0.0011","11.0441","0.0004","20.7262","0.0007","90","","104.622","0.001","90","","7307.6","0.4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H68 Fe K1.5 O27 S20 -","- C49 H56 Fe K1.5 O27 S20 -","- C196 H224 Fe4 K6 O108 S80 -","4","1","","Martin, Lee; Day, Peter; Clegg, William; Harrington, Ross W.; Horton, Peter N.; Bingham, Ann; Hursthouse, Michael B.; McMillan, Paul; Firth, Steven","Multi-layered molecular charge-transfer salts containing alkali metal ions","Journal of Materials Chemistry","2007","17","31","3324","","10.1039/b702442h","","","0.6712","synchrotron","","0.0596","0.0424","","","0.1037","0.1126","","","","","","1.031","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202838","15.5151","0.001","26.5664","0.0015","21.5476","0.001","90","","94.433","0.001","90","","8854.9","0.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C84 H152 O72 S28 Zr12 -","- C84 H112 O72 S28 Zr12 -","- C168 H224 O144 S56 Zr24 -","2","0.5","","Faccini, Francesco; Fric, Helmut; Schubert, Ulrich; Wendel, Eric; Tsetsgee, Otgontuul; Müller, Klaus; Bertagnolli, Helmut; Venzo, Alfonso; Gross, Silvia","ω-Mercapto-functionalized hafnium- and zirconium-oxoclusters as nanosized building blocks for inorganic‒organic hybrid materials: synthesis, characterization and photothiol-ene polymerization","Journal of Materials Chemistry","2007","17","31","3297","","10.1039/b702714a","","","0.71073","MoKα","","0.1759","0.1451","","","0.4083","0.4349","","","","","","1.737","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202839","27.422","0.0012","26.4804","0.0011","25.5136","0.0011","90","","108.486","0.001","90","","17570.6","1.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C87 H158 Hf12 O74 S29 -","- C87 H116 Hf12 O74 S29 -","- C348 H464 Hf48 O296 S116 -","4","1","","Faccini, Francesco; Fric, Helmut; Schubert, Ulrich; Wendel, Eric; Tsetsgee, Otgontuul; Müller, Klaus; Bertagnolli, Helmut; Venzo, Alfonso; Gross, Silvia","ω-Mercapto-functionalized hafnium- and zirconium-oxoclusters as nanosized building blocks for inorganic‒organic hybrid materials: synthesis, characterization and photothiol-ene polymerization","Journal of Materials Chemistry","2007","17","31","3297","","10.1039/b702714a","","","0.71073","MoKα","","0.0798","0.0647","","","0.1719","0.1803","","","","","","1.024","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202858","7.53","0.0015","12.173","0.002","40.996","0.008","90","","90","","90","","3757.8","1.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","4-3, 4-dicyanophenoxy-4'-dimethylaminoazobenzene(CPMAB)","4-3, 4-dicyanophenoxy-4'-dimethylaminoazobenzene(CPMAB)","","- C22 H17 N5 O -","- C22 H17 N5 O -","- C176 H136 N40 O8 -","8","1","","Hu, Junping; Li, Yingfeng; Ji, Zhuoyu; Jiang, Guiyuan; Yang, Lianming; Hu, Wenping; Gao, Hongjun; Jiang, Lei; Wen, Yongqiang; Song, Yanlin; Zhu, Daoben","A non-planar organic molecule with non-volatile electrical bistability for nano-scale data storage","Journal of Materials Chemistry","2007","17","33","3530","","10.1039/b703332j","","","0.71073","MoKα","","0.0939","0.0476","","","0.1148","0.1331","","","","","","0.96","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202871","10.215","0.001","10.697","0.001","10.722","0.001","67.49","0.01","89.98","0.01","68.65","0.01","994.8","0.2","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","(NH3(CH2)4NH3)La(hedpH)(hedpH2)","","","- C8 H25 La N2 O14 P4 -","- C8 H25 La N2 O14 P4 -","- C16 H50 La2 N4 O28 P8 -","2","1","","Liu, Feng-Yi; Roces, Laura; Sa Ferreira, Rute A.; García-Granda, Santiago; García, José R.; Carlos, Luis D.; Rocha, João","Crystal structure and photoluminescence properties of lanthanide diphosphonates","Journal of Materials Chemistry","2007","17","35","3696","","10.1039/b703487c","","x-ray","1.54184","CuKα","","0.0501","0.0498","","","0.1358","0.1363","","","","","","1.068","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202872","28.817","0.005","14.767","0.002","29.597","0.005","90","","103.763","0.004","90","","12233","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H73 Mo3 N8 O0.5 S16 -","- C38 H72 Mo3 N8 O0.5 S16 -","- C304 H576 Mo24 N64 O4 S128 -","8","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1309","0.0573","","","0.1265","0.1599","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202873","14.4374","0.0006","21.6924","0.0009","17.2853","0.0007","90","","103.744","0.001","90","","5258.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H16 Mo3 N6 S32 -","- C26 H16 Mo3 N6 S32 -","- C104 H64 Mo12 N24 S128 -","4","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.0469","0.027","","","0.0748","0.0859","","","","","","0.988","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202874","12.903","0.007","13.733","0.008","17.658","0.011","92.982","0.015","109.882","0.014","117.707","0.013","2521","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H44 Br6 Mo3 N S12 Se3 -","- C26 H8 Br6 Mo3 N S12 Se3 -","- C52 H16 Br12 Mo6 N2 S24 Se6 -","2","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1883","0.0751","","","0.1686","0.236","","","","","","1.005","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202875","10.0467","0.001","11.3217","0.0012","14.8607","0.0015","105.133","0.002","92.035","0.002","99.297","0.003","1604.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H11 Cl6 Mo3 N S15 -","- C12 H8 Cl6 Mo3 N S15 -","- C24 H16 Cl12 Mo6 N2 S30 -","2","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1135","0.0589","","","0.1058","0.1147","","","","","","0.948","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202876","11.8603","0.0009","17.3577","0.0013","20.8821","0.0015","69.39","0.002","88.139","0.002","73.734","0.002","3852.3","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H35 Cl6.5 Mo3 N S39 -","- C42 H32 Cl6.5 Mo3 N S39 -","- C84 H64 Cl13 Mo6 N2 S78 -","2","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1759","0.0655","","","0.1124","0.1549","","","","","","0.992","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202878","7.2695","0.0009","7.2695","0.0009","28.268","0.005","90","","90","","90","","1493.8","0.4","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- C32 H10 Cu6.44 N32 O5 W4 -","- C16 Cu3.22 N16 O2.5 W2 -","- C32 Cu6.44 N32 O5 W4 -","2","0.0625","","Podgajny, Robert; Chmel, Nikola Paul; Bałanda, Maria; Tracz, Piotr; Gaweł, Bartłomiej; Zając, Dariusz; Sikora, Marcin; Kapusta, Czesław; Łasocha, Wiesław; Wasiutyński, Tadeusz; Sieklucka, Barbara","Exploring the formation of 3D ferromagnetic cyano-bridged CuII2+x{CuII4[WV(CN)8]4‒2x[WIV(CN)8]2x}·yH2O networks","Journal of Materials Chemistry","2007","17","31","3308","","10.1039/b703640j","powder diffraction","","1.54178","CuKα","","0.0251","0.0251","","","0.0249","0.0249","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202879","7.2858","0.0009","7.2858","0.0009","28.282","0.005","90","","90","","90","","1501.3","0.4","","","273","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- C32 H8 Cu6.94 N32 O4 W4 -","- C16 Cu3.468 N16 O2 W2 -","- C32 Cu6.936 N32 O4 W4 -","2","0.0625","","Podgajny, Robert; Chmel, Nikola Paul; Bałanda, Maria; Tracz, Piotr; Gaweł, Bartłomiej; Zając, Dariusz; Sikora, Marcin; Kapusta, Czesław; Łasocha, Wiesław; Wasiutyński, Tadeusz; Sieklucka, Barbara","Exploring the formation of 3D ferromagnetic cyano-bridged CuII2+x{CuII4[WV(CN)8]4‒2x[WIV(CN)8]2x}·yH2O networks","Journal of Materials Chemistry","2007","17","31","3308","","10.1039/b703640j","powder diffraction","x-ray","1.54178","CuKα","","0.0525","0.0525","","","0.0436","0.0436","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202880","15.244","0.005","15.244","0.005","16.059","0.005","90","0.005","90","0.005","120","0.005","3231.8","1.8","293","2","293","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C27 H18 N4 -","- C27 H18 N4 -","- C162 H108 N24 -","6","0.333333","","Tian, Yu-Peng; Li, Lin; Zhang, Ju-Zhou; Yang, Jia-Xiang; Zhou, Hong-ping; Wu, Jie-ying; Sun, Ping-ping; Tao, Li-min; Guo, Ya-hui; Wang, Chuan-Kui; Xing, Hui; Huang, Wen-hao; Tao, Xu-Tang; Jiang, Min-Hua","Investigations and facile synthesis of a series of novel multi-functional two-photon absorption materials","Journal of Materials Chemistry","2007","17","34","3646","","10.1039/b703853d","","","0.71069","MoKα","","0.1803","0.0757","","","0.183","0.2335","","","","","","0.939","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202889","17.505","0.0007","19.432","0.0015","24.759","0.0018","90","","90","","90","","8422","1","295","2","295","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C144 H38 N4 S8 -","- C144 H38 N4 S8 -","- C576 H152 N16 S32 -","4","1","","Konarev, Dmitri V.; Khasanov, Salavat S.; Saito, Gunzi; Otsuka, Akihiro; Lyubovskaya, Rimma N.","Dimerization of C60˙‒ in multi-component ionic complexes with bis(ethylenedithio)tetrathiafulvalene: (cation+)2·ET·(C60˙‒)2","Journal of Materials Chemistry","2007","17","39","4171","","10.1039/b704371f","","","0.71073","MoKα","","0.1132","0.0706","","","0.1776","0.205","","","","","","0.972","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202890","17.218","0.0004","19.362","0.0009","24.373","0.0012","90","","90","","90","","8125.3","0.6","100","2","100","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C144 H38 N4 S8 -","- C144 H38 N4 S8 -","- C576 H152 N16 S32 -","4","1","","Konarev, Dmitri V.; Khasanov, Salavat S.; Saito, Gunzi; Otsuka, Akihiro; Lyubovskaya, Rimma N.","Dimerization of C60˙‒ in multi-component ionic complexes with bis(ethylenedithio)tetrathiafulvalene: (cation+)2·ET·(C60˙‒)2","Journal of Materials Chemistry","2007","17","39","4171","","10.1039/b704371f","","","0.71073","MoKα","","0.1417","0.1142","","","0.3194","0.3478","","","","","","1.393","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202901","8.956","0.0006","12.0233","0.0009","19.2448","0.0014","83.695","0.002","87.711","0.002","73.878","0.002","1978.7","0.2","100","1","100","1","","","","","","","","7","P -1","-P 1","2","Mn (1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene) (hfac)2","Mn [1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene] (hfac)2","","- C35 H18 F18 Mn N4 O7 S2 -","- C35 H18 F18 Mn N4 O7 S2 -","- C70 H36 F36 Mn2 N8 O14 S4 -","2","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71073","MoKα","","0.0845","0.0467","","","0.1054","0.118","","","","","","1.045","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202902","7.9782","0.0007","12.8551","0.001","23.714","0.002","90","","92.789","0.004","90","","2429.2","0.4","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene","1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene","","- C25 H16 F6 N4 O3 S2 -","- C25 H16 F6 N4 O3 S2 -","- C100 H64 F24 N16 O12 S8 -","4","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71073","MoKα","","0.0558","0.0431","","","0.1071","0.1144","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202903","8.946","0.005","11.774","0.005","19.493","0.005","92.804","0.005","91.091","0.005","105.202","0.005","1977.9","1.5","100","1","100","1","","","","","","","","7","P -1","-P 1","2","Cu (1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene) (hfac)2","Cu [1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene] (hfac)2","","- C35 H18 Cu F18 N4 O7 S2 -","- C35 H18 Cu F18 N4 O7 S2 -","- C70 H36 Cu2 F36 N8 O14 S4 -","2","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71069","MoKα","","0.0636","0.0387","","","0.0927","0.1033","","","","","","0.995","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202904","25.685","0.005","14.069","0.005","16.562","0.005","90","","114.662","0.005","90","","5439","3","100","1","100","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Ag (1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene)2 (CF3SO3)2","Ag [1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene]2 (CF3SO3)2","","- C51 H32 Ag F15 N8 O9 S5 -","- C51 H32 Ag F15 N8 O9 S5 -","- C204 H128 Ag4 F60 N32 O36 S20 -","4","0.5","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71069","MoKα","","0.0569","0.0363","","","0.0813","0.095","","","","","","1.004","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202905","16.5004","0.0007","11.8425","0.0005","14.132","0.0007","90","","98.387","0.002","90","","2731.9","0.2","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1,2-bis(5-ethoxy-2-(4-nitro- phenyl)thiazoyl)perfluorocyclopentene","1,2-bis[5-ethoxy-2-(4-nitro-phenyl)thiazoyl]perfluorocyclopentene","","- C27 H18 F6 N4 O6 S2 -","- C27 H18 F6 N4 O6 S2 -","- C108 H72 F24 N16 O24 S8 -","4","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71073","MoKα","","0.0925","0.0717","","","0.1873","0.2089","","","","","","1.025","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202907","9.9866","0.0011","9.9866","0.0011","9.9866","0.0011","90","","90","","90","","995.99","0.19","50","2","50","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Ga Nb4 S8 -","- Ga Nb4 S8 -","- Ga4 Nb16 S32 -","4","0.0416667","","Jakob, Stefanie; Müller, Helen; Johrendt, Dirk; Altmannshofer, Sandra; Scherer, Wolfgang; Rayaprol, Sudhindra; Pöttgen, Rainer","Structural and magnetic transitions in the Mott insulator GaNb4S8","Journal of Materials Chemistry","2007","17","36","3833","","10.1039/b704943a","","","0.71073","MoKα","","0.0358","0.0127","","","0.0478","0.0485","","","","","","1.351","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202908","9.9917","0.0014","9.9917","0.0014","9.978","0.002","90","","90","","90","","996.1","0.3","20","2","20","0.1","","","","","","","","3","P -4 21 m","P -4 2ab","113","","","","- Ga Nb4 S8 -","- Ga Nb4 S8 -","- Ga4 Nb16 S32 -","4","0.5","","Jakob, Stefanie; Müller, Helen; Johrendt, Dirk; Altmannshofer, Sandra; Scherer, Wolfgang; Rayaprol, Sudhindra; Pöttgen, Rainer","Structural and magnetic transitions in the Mott insulator GaNb4S8","Journal of Materials Chemistry","2007","17","36","3833","","10.1039/b704943a","","","0.71073","MoKα","","0.0273","0.0265","","","0.0778","0.079","","","","","","1.145","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202912","9.405","0.003","10.934","0.004","17.343","0.006","84.339","0.005","86.416","0.006","70.879","0.005","1676","1","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H30 N2 O -","- C44 H30 N2 O -","- C88 H60 N4 O2 -","2","1","","Chen, Shiyan; Xu, Xinjun; Liu, Yunqi; Qiu, Wenfeng; Yu, Gui; Sun, Xiaobo; Zhang, Hengjun; Qi, Ting; Lu, Kun; Gao, Xike; Liu, Ying; Zhu, Daoben","Highly efficient blue electrophosphorescent devices with a new series of host materials: polyphenylene-dendronized oxadiazole derivatives","Journal of Materials Chemistry","2007","17","36","3788","","10.1039/b705515c","","","0.71073","MoKα","","0.1364","0.0551","","","0.1184","0.1667","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202944","20.268","0.003","10.0519","0.0013","22.389","0.003","90","","90","","90","","4561.4","1.1","293","2","293","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C62 H52 -","- C62 H52 -","- C248 H208 -","4","0.5","","Kim, Soo-Kang; Park, Young-Il; Kang, In-Nam; Park, Jong-Wook","New deep-blue emitting materials based on fully substituted ethylene derivatives","Journal of Materials Chemistry","2007","17","44","4670","","10.1039/b706606f","","","0.71073","MoKα","","0.3411","0.1204","","","0.2709","0.4222","","","","","","0.972","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202995","22.745","0.003","13.9148","0.0018","12.2573","0.0016","90","","119.369","0.002","90","","3380.8","0.8","292","2","292","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C38 H47 N5 -","- C38 H47 N5 -","- C152 H188 N20 -","4","0.5","","Liu, Zijun; Chen, Tao; Liu, Bo; Huang, Zhen-Li; Huang, Ting; Li, Suyue; Xu, Yuxi; Qin, Jingui","Two-photon absorption of a series of V-shape molecules: the influence of acceptor's strength on two-photon absorption in a noncentrosymmetric D‒π‒A‒π‒D system","Journal of Materials Chemistry","2007","17","44","4685","","10.1039/b707909e","","","0.71073","MoKα","","0.1235","0.0694","","","0.1725","0.2053","","","","","","0.977","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7202996","7.9565","0.0011","13.906","0.002","22.415","0.004","90","","90","","90","","2480.1","0.7","113","","113","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C H5 F7 N Yb2 -","- C H5 F7 N Yb2 -","- C16 H80 F112 N16 Yb32 -","16","0.5","","Jayasundera, Anil C. A.; Finch, Adrian A.; Townsend, P. D.; Lightfoot, Philip","Hydrothermal synthesis and luminescent properties of a new family of organically templated lanthanide fluorides","Journal of Materials Chemistry","2007","17","39","4178","","10.1039/b707993a","","","0.71073","MoKα","","0.0246","0.0194","","","0.0435","0.0458","","","","","","1.042","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202997","11.9753","0.0008","23.2559","0.0016","6.8413","0.0005","90","","110.384","0.001","90","","1786","0.2","90","2","90","2","","","","","","","","4","C 1 c 1","C -2yc","9","C2HN6O4, C2H5N4, 2(C2H4N4), H2O","","","- C8 H16 N18 O5 -","- C8 H16 N18 O5 -","- C32 H64 N72 O20 -","4","1","","Zhuo Zeng; Haixiang Gao; Brendan Twamley; Jean'ne M. Shreeve","Energetic mono and dibasic 5-dinitromethyltetrazolates: synthesis, properties, and particle processing","Journal of Materials Chemistry","2007","17","36","3819","","10.1039/b708041g","","","0.71073","MoKα","","0.0382","0.0336","","","0.0752","0.0774","","","","","","1.035","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202998","15.7214","0.001","12.7935","0.0008","8.1458","0.0005","90","","121.096","0.001","90","","1402.95","0.15","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","(C4H7N2)2(C2N6O4)","","","- C10 H14 N10 O4 -","- C10 H14 N10 O4 -","- C40 H56 N40 O16 -","4","0.5","","Zhuo Zeng; Haixiang Gao; Brendan Twamley; Jean'ne M. Shreeve","Energetic mono and dibasic 5-dinitromethyltetrazolates: synthesis, properties, and particle processing","Journal of Materials Chemistry","2007","17","36","3819","","10.1039/b708041g","","","0.71073","MoKα","","0.0424","0.0337","","","0.0819","0.0877","","","","","","1.019","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7203045","10.514","0.002","11.309","0.003","16.393","0.005","83.502","0.014","78.733","0.016","69.532","0.013","1788.8","0.8","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","","","- C48 H46 N2 -","- C48 H46 N2 -","- C96 H92 N4 -","2","1","","Song, Yabin; Di, Chong-an; Xu, Wei; Liu, Yunqi; Zhang, Deqing; Zhu, Daoben","New semiconductors based on triphenylamine with macrocyclic architecture: synthesis, properties and applications in OFETs","Journal of Materials Chemistry","2007","17","42","4483","","10.1039/b708887f","","","0.7107","MoKα","","0.0963","0.0578","","","0.1248","0.1452","","","","","","1.015","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203055","22.3238","0.0011","10.0035","0.0005","38.1841","0.0018","90","","90","","90","","8527.1","0.7","113","2","113","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C96 H106 Er2 N4 O12 -","- C96 H106 Er2 N4 O12 -","- C384 H424 Er8 N16 O48 -","4","0.5","","Song, Limei; Liu, Xinhou; Zhen, Zhen; Chen, Cong; Zhang, Daming","Solution-processable erbium‒ytterbium complex for potential planar optical amplifier application","Journal of Materials Chemistry","2007","17","43","4586","","10.1039/b709237g","","","0.7107","MoKα","","0.0572","0.0509","","","0.0826","0.0845","","","","","","1.282","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203065","10.9387","0.0011","11.4172","0.0013","14.3741","0.0016","90","","99.686","0.007","90","","1769.6","0.3","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 S4 -","- C22 H14 S4 -","- C88 H56 S16 -","4","1","","Zhao, Tianyue; Wei, Zhongming; Song, Yabin; Xu, Wei; Hu, Wenping; Zhu, Daoben","Tetrathia[22]annulene[2,1,2,1]: physical properties, crystal structure and application in organic field-effect transistors","Journal of Materials Chemistry","2007","17","41","4377","","10.1039/b709324a","","","0.7107","MoKα","","0.0533","0.0417","","","0.0894","0.0953","","","","","","1.123","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203103","13.3247","0.0011","16.22","0.0014","17.2825","0.0014","83.458","0.005","86.262","0.007","84.888","0.007","3690.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H58 Hf N2 O8 -","- C30 H58 Hf N2 O8 -","- C120 H232 Hf4 N8 O32 -","4","2","","Milanov, A.; Bhakta, R.; Thomas, R.; Ehrhart, P.; Winter, M.; Waser, R.; Devi, A.","Mixed amide‒malonate compound of hafnium as a novel monomeric precursor for MOCVD of HfO2 thin films","Journal of Materials Chemistry","2006","16","5","437","","10.1039/b509380e","","","0.71073","MoKα","","0.0716","0.0525","","","0.1344","0.1506","","","","","","0.975","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7203104","36.062","0.002","9.1053","0.0003","4.6794","0.0003","90","","90","","90","","1536.51","0.14","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","octylsemicarbazid","ethyl2-[(octylamino)carbonyl]hydrazinecarboxylate","","- C12 H25 N3 O3 -","- C12 H25 N3 O3 -","- C48 H100 N12 O12 -","4","1","","Deindörfer, Pia; Geiger, Thomas; Schollmeyer, Dieter; Ye, Jian Hui; Zentel, Rudolf","Semicarbazides as gel forming agents for common solvents and liquid crystals","Journal of Materials Chemistry","2006","16","4","351","","10.1039/b510474b","","","1.54178","CuKα","","0.0628","0.0487","","","0.1284","0.1378","","","","","","1.026","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7203105","19.5706","0.0003","20.7246","0.0005","14.1497","0.0003","90","","118.309","0.001","90","","5052.65","0.19","293","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H42 Cl3 Mn2 N15 O12 -","- C42 H42 Cl3 Mn2 N15 O12 -","- C168 H168 Cl12 Mn8 N60 O48 -","4","0.5","","Karmakar, Tapan K.; Aromí, Guillem; Ghosh, Barindra K.; Usman, A.; Fun, Hoong-Kun; Mallah, Talal; Behrens, U.; Solans, Xavier; Chandra, Swapan K.","Unexpected diversity and novel features within a family of new azide-bridged MnII complexes of pyridyl/imine ligands","Journal of Materials Chemistry","2006","16","3","278","","10.1039/b510701f","","","0.71073","MoKα","","0.1684","0.0877","","","0.2214","0.2506","","","","","","0.876","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203106","9.4938","0.0001","16.1284","0.0002","12.8164","0.0001","90","","94.5494","0.0002","90","","1956.26","0.04","293","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 F12 Mn2 N14 P2 -","- C30 H32 F12 Mn2 N14 P2 -","- C60 H64 F24 Mn4 N28 P4 -","2","0.5","","Karmakar, Tapan K.; Aromí, Guillem; Ghosh, Barindra K.; Usman, A.; Fun, Hoong-Kun; Mallah, Talal; Behrens, U.; Solans, Xavier; Chandra, Swapan K.","Unexpected diversity and novel features within a family of new azide-bridged MnII complexes of pyridyl/imine ligands","Journal of Materials Chemistry","2006","16","3","278","","10.1039/b510701f","","","0.71073","MoKα","","0.0685","0.0453","","","0.098","0.1036","","","","","","0.927","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203107","12.5606","0.0006","17.25","0.0008","18.1617","0.0009","90","","90","","90","","3935.1","0.3","153","2","153","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C16 H18 Cl Mn N7 O4 -","- C16 H18 Cl Mn N7 O4 -","- C128 H144 Cl8 Mn8 N56 O32 -","8","1","","Karmakar, Tapan K.; Aromí, Guillem; Ghosh, Barindra K.; Usman, A.; Fun, Hoong-Kun; Mallah, Talal; Behrens, U.; Solans, Xavier; Chandra, Swapan K.","Unexpected diversity and novel features within a family of new azide-bridged MnII complexes of pyridyl/imine ligands","Journal of Materials Chemistry","2006","16","3","278","","10.1039/b510701f","","","0.71073","MoKα","","0.0849","0.0585","","","0.1502","0.1637","","","","","","1.025","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203110","16.029","0.003","23.026","0.004","7.003","0.004","90","0","103.96","0.03","90","0","2508.4","1.6","295","2","","","","","","","","","Local laboratory","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 F6 O4 P S6 -","- C20 H16 F6 O4 P S6 -","- C80 H64 F24 O16 P4 S24 -","4","0.5","","Yamochi, Hideki; Hagiwara, Jun; Soeda, Masaya; Saito, Gunzi","Synthesis and charge-transfer complexes of a new donor molecule, TP-EDOT","Journal of Materials Chemistry","2006","16","6","550","","10.1039/b511512d","","","0.71073","MoKα","","","0.052","","","0.06","","","","","2.872","2.872","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203111","19.599","0.005","10.953","0.003","10.555","0.003","90","","101.11","0.02","90","","2223.4","1.1","295","2","295","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","(TP-EDOT)3Sb2F11(benzene)","","","- C36 H30 F11 O6 S9 Sb2 -","- C36 H22 F11 O6 S9 Sb2 -","- C72 H44 F22 O12 S18 Sb4 -","2","0.5","","Yamochi, Hideki; Hagiwara, Jun; Soeda, Masaya; Saito, Gunzi","Synthesis and charge-transfer complexes of a new donor molecule, TP-EDOT","Journal of Materials Chemistry","2006","16","6","550","","10.1039/b511512d","","","0.71073","MoKα","","0.1034","0.0681","","","0.1622","0.1749","","","","","","1.114","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203118","26.823","0.006","7.876","0.002","13.259","0.003","90","","95.994","0.006","90","","2785.8","1.1","293","","293","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C16 H8 Cl I4 O4 S4 Se4 -","- C16 H8 Cl I4 O4 S4 Se4 -","- C64 H32 Cl4 I16 O16 S16 Se16 -","4","0.5","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.0643","0.0501","","","0.1131","0.1194","","","","","","1.053","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203119","7.8146","0.0014","30.306","0.005","13.253","0.002","90","","90","","90","","3138.7","0.9","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C16 H12 Br I4 O2 S12 -","- C16 H8 Br I4 O2 S12 -","- C64 H32 Br4 I16 O8 S48 -","4","0.5","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.0752","0.0612","","","0.1787","0.188","","","","","","1.041","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203120","7.876","0.003","14.217","0.005","30.851","0.011","90","","95.721","0.007","90","","3437","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H10 Cl3 I4 S4 Se8 -","- C17 H10 Cl3 I4 S4 Se8 -","- C68 H40 Cl12 I16 S16 Se32 -","4","0.5","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.1525","0.1135","","","0.2782","0.3006","","","","","","1.1","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7203121","7.834","0.003","14.257","0.005","30.885","0.009","90","","95.789","0.007","90","","3432","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C17 H10 Br Cl2 I4 S4 Se8 -","- C17 H10 Br Cl2 I4 S4 Se8 -","- C68 H40 Br4 Cl8 I16 S16 Se32 -","4","0.5","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.1015","0.0544","","","0.1004","0.1126","","","","","","0.89","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7203122","7.5692","0.0012","13.544","0.002","13.781","0.002","91.385","0.004","101.128","0.003","104.257","0.003","1339.7","0.4","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H8 Cl I4 O4 S8 -","- C16 H8 Cl I4 O4 S8 -","- C32 H16 Cl2 I8 O8 S16 -","2","1","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.0506","0.0467","","","0.1124","0.115","","","","","","1.166","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203123","7.6511","0.0016","13.7","0.003","14.006","0.003","90.804","0.005","101.885","0.004","104.209","0.004","1389.5","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H8 Br I4 O4 S8 -","- C16 H8 Br I4 O4 S8 -","- C32 H16 Br2 I8 O8 S16 -","2","1","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.0547","0.0449","","","0.111","0.1166","","","","","","1.065","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203124","7.6396","0.0019","13.416","0.003","14.049","0.003","91.468","0.006","100.217","0.005","105.839","0.006","1359.1","0.5","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H8 Cl I4 O4 S4 Se4 -","- C16 H8 Cl I4 O4 S4 Se4 -","- C32 H16 Cl2 I8 O8 S8 Se8 -","2","1","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.0908","0.0658","","","0.1573","0.1699","","","","","","0.967","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203125","7.709","0.002","13.546","0.004","14.219","0.004","90.866","0.007","100.943","0.006","105.857","0.006","1398.8","0.7","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H8 Br I4 O4 S4 Se4 -","- C16 H8 Br I4 O4 S4 Se4 -","- C32 H16 Br2 I8 O8 S8 Se8 -","2","1","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.1163","0.0736","","","0.1441","0.1638","","","","","","0.979","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203126","7.6827","0.0011","30.305","0.004","13.1946","0.0019","90","","90","","90","","3072","0.7","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C16 H12 Cl I4 O2 S12 -","- C16 H8 Cl I4 O2 S12 -","- C64 H32 Cl4 I16 O8 S48 -","4","0.5","","Imakubo, Tatsuro; Shirahata, Takashi; Hervé, Katel; Ouahab, Lahcène","Supramolecular organic conductors based on diiodo-TTFs and spherical halide ion X‒(X = Cl, Br)","Journal of Materials Chemistry","2006","16","2","162","","10.1039/b512036e","","","0.71073","MoKα","","0.0485","0.0379","","","0.0914","0.0958","","","","","","1","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203134","23.4804","0.0013","11.7367","0.0007","7.365","0.0004","90","","90","","90","","2029.7","0.2","273","2","273","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2,4,6-Tris(benzyloxy)-1,3,5-triazine","","- C24 H21 N3 O3 -","- C24 H21 N3 O3 -","- C96 H84 N12 O12 -","4","1","","Srinivas, K.; Sitha, Sanyasi; Rao, V. Jayathirtha; Bhanuprakash, K.; Ravikumar, K.","NLO Activity in some non-conjugated 3D triazine derivatives: a non-centrosymmetric crystal through conformational flexibility","Journal of Materials Chemistry","2006","16","5","496","","10.1039/b512362c","","","0.71073","MoKα","","0.0529","0.0483","","","0.115","0.1177","","","","","","1.139","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203135","9.9509","0.0002","25.1959","0.0005","9.0316","0.0002","90","","90","","90","","2264.42","0.08","100","0.1","100","0.1","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C52 H36 Cl4 N4 O S2 -","- C52 H36 Cl4 N4 O S2 -","- C104 H72 Cl8 N8 O2 S4 -","2","0.5","","Huang, Ping-Hsin; Shen, Jiun-Yi; Pu, Shin-Chien; Wen, Yuh-Sheng; Lin, Jiann T.; Chou, Pi-Tai; Yeh, Ming-Chang P.","Synthesis and characterization of new fluorescent two-photon absorption chromophores","Journal of Materials Chemistry","2006","16","9","850","","10.1039/b512524c","","","0.71073","MoKα","","0.0551","0.0464","","","0.1286","0.1349","","","","","","1.11","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203145","9.617","0.003","13.895","0.003","21.695","0.006","87.83","0.011","84.549","0.009","72.903","0.01","2758.3","1.3","153","2","173","2","","","","","","","","3","P -1","-P 1","2","","Dodecithiophene","","- C120 H170 S12 -","- C120 H170 S12 -","- C120 H170 S12 -","1","0.5","","Azumi, Reiko; Mena-Osteritz, Elena; Boese, Roland; Benet-Buchholz, Jordi; Bäuerle, Peter","The longest oligothiophene ever examined by X-ray structure analysis","Journal of Materials Chemistry","2006","16","8","728","","10.1039/b513427g","","","0.71073","MoKα","","0.1777","0.063","","","0.1135","0.1445","","","","","","0.796","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203158","6.686","0.001","8.672","0.001","16.095","0.003","99.91","0.01","101.54","0.01","94.59","0.01","894.3","0.2","295","2","295","2","","","","","","","synthesised by authors, see text","6","P -1","-P 1","2","","bis(bis(ethylenedithio)tetrathiafulvalene)(pentacyano-(nitroso)-iron)","","- C25 H16 Fe N6 O S16 -","- C25 H16 Fe N6 O S16 -","- C25 H16 Fe N6 O S16 -","1","0.5","","Simonov, S. V.; Zorina, L. V.; Khasanov, S. S.; Shibaeva, R. P.; Shevyakova, I. Yu.; Buravov, L. I.; Yagubskii, E. B.; Canadell, E.","Molecular conductors with the common and robust building block (BEDT-TTF)2NP (NP = [FeNO(CN)5]2‒) but different band filling","Journal of Materials Chemistry","2006","16","8","787","","10.1039/b514912f","","","0.71073","MoKα","","0.0913","0.0562","","","0.1195","0.1329","","","","","","1.009","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7203159","19.481","0.003","8.6405","0.001","16.441","0.002","98.894","0.01","93.169","0.01","100.273","0.01","2680.5","0.6","295","2","295","2","","","","","","","synthesised by authors, see text","6","P -1","-P 1","2","","tris(bis(ethylenedithio)tetrathiafulvalene)(pentacyano-(nitroso)-iron) ethylene glycole solvate","","- C37 H30 Fe N6 O3 S24 -","- C37 H30 Fe N6 O3 S24 -","- C74 H60 Fe2 N12 O6 S48 -","2","1","","Simonov, S. V.; Zorina, L. V.; Khasanov, S. S.; Shibaeva, R. P.; Shevyakova, I. Yu.; Buravov, L. I.; Yagubskii, E. B.; Canadell, E.","Molecular conductors with the common and robust building block (BEDT-TTF)2NP (NP = [FeNO(CN)5]2‒) but different band filling","Journal of Materials Chemistry","2006","16","8","787","","10.1039/b514912f","","","0.71073","MoKα","","0.0871","0.0471","","","0.1168","0.1356","","","","","","0.961","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7203160","10.001","0.0001","19.579","0.0002","25.715","0.0003","90","","93.051","0.001","90","","5028.11","0.09","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C91 H27 N O -","- C91 H27 N O -","- C364 H108 N4 O4 -","4","1","","Padmawar, Prashant A.; Canteenwala, Taizoon; Verma, Sarika; Tan, Loon-Seng; Chiang, Long Y.","Synthesis and characterization of photoresponsive diphenylaminofluorene chromophore adducts of [60]fullerene","Journal of Materials Chemistry","2006","16","14","1366","","10.1039/b515055h","","","0.71073","MoKα","","0.0786","0.0524","","0.151","0.1279","","","","1.126","1.155","1.155","","","","","has coordinates","180362","2020-10-21","18:00:00",""
"7203161","21.932","0.002","25.059","0.002","40.88","0.004","90","","90","","90","","22467","3","120","2","120","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","tetrakis(9,9-dihexyl-2-(pyridin-2-yl)fluorene-C^2^,N')-bis-(μ- chloro)diiridium, bis(dichloromethane) hydrate","","- C122 H150 Cl6 Ir2 N4 O -","- C122 H148 Cl6 Ir2 N4 O -","- C976 H1184 Cl48 Ir16 N32 O8 -","8","0.25","","Bettington, Sylvia; Tavasli, Mustafa; Bryce, Martin R.; Batsanov, Andrei S.; Thompson, Amber L.; Al Attar, Hameed A.; Dias, Fernando B.; Monkman, Andrew P.","Bridged diiridium complexes for electrophosphorescent OLEDs: synthesis, X-ray crystal structures, photophysics, and devices","Journal of Materials Chemistry","2006","16","11","1046","","10.1039/b515258e","","","0.71073","MoKα","","0.119","0.0807","","","0.2002","0.2335","","","","","","1.272","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7203162","14.403","0.004","15.041","0.004","16.055","0.004","77.58","0.01","70.27","0.01","79.47","0.01","3174.2","1.5","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","bis(9,9,-dihexyl-2-pyridin-2-yl)fluorene-C^2^,N')- dimethylsulphoxide iridium(III) isocyanate, bis-dimethylsulphoxide solvate","","- C67 H90 Ir N3 O4 S3 -","- C67 H90 Ir N3 O4 S3 -","- C134 H180 Ir2 N6 O8 S6 -","2","1","","Bettington, Sylvia; Tavasli, Mustafa; Bryce, Martin R.; Batsanov, Andrei S.; Thompson, Amber L.; Al Attar, Hameed A.; Dias, Fernando B.; Monkman, Andrew P.","Bridged diiridium complexes for electrophosphorescent OLEDs: synthesis, X-ray crystal structures, photophysics, and devices","Journal of Materials Chemistry","2006","16","11","1046","","10.1039/b515258e","","","0.71073","MoKα","","0.027","0.0239","","","0.0609","0.0627","","","","","","1.049","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7203182","6.9146","0.0014","7.0143","0.0019","10.59","0.002","100.178","0.019","97.31","0.017","117.655","0.016","434.7","0.19","295","2","295","2","","","","","","","","4","P -1","-P 1","2","HMI-Au(CN)2","","","- C6 H7 Au N4 -","- C6 H7 Au N4 -","- C12 H14 Au2 N8 -","2","1","","Yoshida, Yukihiro; Fujii, Junichi; Saito, Gunzi; Hiramatsu, Takaaki; Sato, Naoki","Dicyanoaurate(i) salts with 1-alkyl-3-methylimidazolium: luminescent properties and room-temperature liquid forming","Journal of Materials Chemistry","2006","16","8","724","","10.1039/b515869a","","","0.71073","MoK-alpha","","","0.0559","","0.1952","","","","","1.45","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203183","8.3701","0.0017","19.9","0.004","6.6722","0.0018","90","","107.837","0.019","90","","1057.9","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","EMI-Au(CN)2","","","- C8 H11 Au N4 -","- C8 H11 Au N4 -","- C32 H44 Au4 N16 -","4","1","","Yoshida, Yukihiro; Fujii, Junichi; Saito, Gunzi; Hiramatsu, Takaaki; Sato, Naoki","Dicyanoaurate(i) salts with 1-alkyl-3-methylimidazolium: luminescent properties and room-temperature liquid forming","Journal of Materials Chemistry","2006","16","8","724","","10.1039/b515869a","","","0.71073","MoK-alpha","","","0.043","","0.1312","","","","","1.207","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203213","6.339","0.001","9.867","0.001","15.3","0.002","90","","91.05","0.01","90","","956.8","0.2","298","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Co4 Na O12 P3 -","- Co4 Na O12 P3 -","- Co16 Na4 O48 P12 -","4","1","","R. Baies; O. Pérez; V. Caignaert; V. Pralong; B. Raveau","A new sodium cobaltophosphate with a tunnel structure, ionic conductor","Journal of Materials Chemistry","2006","16","25","2434","","10.1039/b516383h","","","0.71069","MoKα","","0.1669","0.0523","","","0.0471","0.0603","","","","1.58","1.58","1.23","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203244","17.087","","18.792","","14.191","","113.58","","109.77","","73.52","","3871.49","","","","","","","","","","","","","3","P -1","-P 1","2","","","","?","- C96 N16 O16 -","- C96 N16 O16 -","","","","Ramasamy P. Pandian; Young-Il Kim; Patrick M. Woodward; Jay L. Zweier; Periakaruppan T. Manoharan; Periannan Kuppusamy","The open molecular framework of paramagnetic lithium octabutoxy-naphthalocyanine: implications for the detection of oxygen and nitric oxide using EPR spectroscopy","Journal of Materials Chemistry","2006","16","36","3609","","10.1039/b517976a","","","","","","","","","","","","","","","","","","","","","has coordinates","180363","2020-10-21","18:00:00",""
"7203245","23.1926","0.0016","14.9481","0.0011","28.015","0.002","90","","103.536","0.001","90","","9442.6","1.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C88 H128 O28 Ti6 -","- C88 H128 O28 Ti6 -","- C352 H512 O112 Ti24 -","4","1","","Yu Gao; Franz René Kogler; Herwig Peterlik; Ulrich Schubert","Ring-opening metathesis polymerizations with norbornene carboxylate-substituted metal oxo clusters","Journal of Materials Chemistry","2006","16","32","3268","","10.1039/b518277h","","","0.71073","MoKα","","0.2136","0.0707","","","0.1642","0.1978","","","","","","0.722","","","","has coordinates","180363","2020-10-21","18:00:00",""
"7203246","15.1389","0.0006","27.919","0.0011","28.2235","0.0011","90","","93.822","0.001","90","","11902.5","0.8","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C120 H142 O38 Zr6 -","- C120 H138 O38 Zr6 -","- C480 H552 O152 Zr24 -","4","1","","Yu Gao; Franz René Kogler; Herwig Peterlik; Ulrich Schubert","Ring-opening metathesis polymerizations with norbornene carboxylate-substituted metal oxo clusters","Journal of Materials Chemistry","2006","16","32","3268","","10.1039/b518277h","","","0.71073","MoKα","","0.1472","0.0768","","","0.1948","0.2234","","","","","","0.965","","","","has coordinates","180363","2020-10-21","18:00:00",""
"7203247","15.621","0.004","15.641","0.004","30.8","0.008","99.36","0.006","95.793","0.005","113.343","0.005","6703","3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C124 H152 O39 Zr6 -","- C124 H147 O39 Zr6 -","- C248 H294 O78 Zr12 -","2","1","","Yu Gao; Franz René Kogler; Herwig Peterlik; Ulrich Schubert","Ring-opening metathesis polymerizations with norbornene carboxylate-substituted metal oxo clusters","Journal of Materials Chemistry","2006","16","32","3268","","10.1039/b518277h","","","0.71073","MoKα","","0.193","0.0975","","","0.2308","0.2728","","","","","","0.927","","","","has coordinates","180363","2020-10-21","18:00:00",""
"7203248","11.39","0.001","12.091","0.002","14.386","0.003","74.85","0.02","78.45","0.02","68.7","0.02","1769.5","0.6","173.1","","","","","","","","","","","5","P -1","-P 1","2","4-(1',3'-oxyl-4',4',5',5'-tetramethyl-imidazolin-2'-yl)- benzoic acid 3,5-bis-(1'',3''-oxyl-4'',4'',5'',5''-tetramethyl- imidazolin-2''-yl)-phenyl ester","4-(1',3'-oxyl-4',4',5',5'-tetramethyl-imidazolin-2'-yl)-benzoic acid 3,5-bis- (1'',3''-oxyl-4'',4'',5'',5''-tetramethyl-imidazolin-2''-yl)-phenyl ester","","- C34.5 H44 Cl N6 O8 -","- C34.5 H43 Cl N6 O8 -","- C69 H86 Cl2 N12 O16 -","2","1","","Kanzaki, Yuki; Shiomi, Daisuke; Kaneda, Chika; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji","Clustering of molecular spins in the crystals of nitronylnitroxide and iminonitroxide triradicals based on benzene-1,3,5-triyl frameworks","Journal of Materials Chemistry","2006","16","21","2064","","10.1039/b518416a","","","0.7107","MoKα","","","0.072","","","","0.219","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203249","11.28","0.007","11.995","0.007","14.345","0.009","74.99","0.02","78.72","0.03","69.63","0.02","1745.5","1.9","293.1","","","","","","","","","","","5","P -1","-P 1","2","4-(1'-oxyl-4',4',5',5'-tetramethyl-imidazolin-2'-yl)-benzoic acid 3,5-bis-(1''-oxyl-4'',4'',5'',5''-tetramethyl-imidazolin-2''-yl)- phenyl ester","4-(1'-oxyl-4',4',5',5'-tetramethyl-imidazolin-2'-yl)-benzoic acid 3,5-bis- (1''-oxyl-4'',4'',5'',5''-tetramethyl-imidazolin-2''-yl)-phenyl ester","","- C34.5 H43 Cl N6 O5 -","- C34.5 H43 Cl N6 O5 -","- C69 H86 Cl2 N12 O10 -","2","1","","Kanzaki, Yuki; Shiomi, Daisuke; Kaneda, Chika; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji","Clustering of molecular spins in the crystals of nitronylnitroxide and iminonitroxide triradicals based on benzene-1,3,5-triyl frameworks","Journal of Materials Chemistry","2006","16","21","2064","","10.1039/b518416a","","","0.7107","MoKα","","","0.099","","","","0.166","","","","","","0.973","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203251","27.0966","0.0012","9.2018","0.0004","13.7101","0.0005","90","","95.859","0.002","90","","3400.6","0.2","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H61 Br N2 O -","- C31 H61 Br N2 O -","- C124 H244 Br4 N8 O4 -","4","1","","Chiou, Josh Y. Z.; Chen, J. N.; Lei, J. S.; Lin, Ivan J. B.","Ionic liquid crystals of imidazolium salts with a pendant hydroxyl group","Journal of Materials Chemistry","2006","16","29","2972","","10.1039/b600045b","","","0.71073","MoKα","","0.1252","0.0448","","","0.1079","0.129","","","","","","0.795","","","","has coordinates","180363","2020-10-21","18:00:00",""
"7203293","5.136","0.0006","7.5227","0.0008","25.623","0.003","90","","91.005","0.002","90","","989.83","0.19","295","1","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H14 N2 O4 -","- C26 H14 N2 O4 -","- C52 H28 N4 O8 -","2","0.5","","Ofir, Yuval; Zelichenok, Alexander; Yitzchaik, Shlomo","1,4;5,8-naphthalene-tetracarboxylic diimide derivatives as model compounds for molecular layer epitaxy","Journal of Materials Chemistry","2006","16","22","2142","","10.1039/b601258b","","","0.71073","MoKα","","0.1313","0.0644","","","0.1037","0.125","","","","","","1.013","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203294","8.2649","0.0015","14.504","0.003","4.8883","0.0009","98.05","0.003","93.611","0.003","96.27","0.003","574.91","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H30 N2 O4 -","- C26 H20 N2 O4 -","- C26 H20 N2 O4 -","1","0.5","","Ofir, Yuval; Zelichenok, Alexander; Yitzchaik, Shlomo","1,4;5,8-naphthalene-tetracarboxylic diimide derivatives as model compounds for molecular layer epitaxy","Journal of Materials Chemistry","2006","16","22","2142","","10.1039/b601258b","","","0.71073","MoKα","","0.1781","0.1401","","","0.3225","0.3502","","","","","","1.187","","","","has coordinates","180363","2020-10-21","18:00:00",""
"7203299","9.0105","0.0013","11.5303","0.001","19.219","0.002","98.337","0.004","99.0796","0.0011","103.549","0.0008","1882.1","0.4","294","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C27 H25 Fe0.5 N O5 S17 -","- C27 H25 Fe0.5 N O5 S17 -","- C54 H50 Fe N2 O10 S34 -","2","1","","Keigo Furuta; Hiroki Akutsu; Jun-ichi Yamada; Shin'ichi Nakatsuji; Scott S. Turner","The first organic molecule-based metal containing ferrocene","Journal of Materials Chemistry","2006","16","16","1504","","10.1039/b601614f","","","0.71069","MoKα","","0.1012","0.0672","","0.043","0.0403","0.0403","","","","","","1.2661","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203300","9.086","0.003","10.859","0.003","16.278","0.004","104.921","0.018","97.54","0.03","103.68","0.02","1476","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C70 H82 O2 -","- C70 H82 O2 -","- C70 H82 O2 -","1","0.5","","Smith, Rhett C.; Gleason, L. Beth; Protasiewicz, John D.","Solution and film photoluminescence of mesityl-substituted PPVs and low molecular weight models","Journal of Materials Chemistry","2006","16","25","2445","","10.1039/b601824f","","","0.71073","MoKα","","0.1229","0.0598","","","0.0784","0.085","","","","","","1.627","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203313","40.092","0.008","10.399","0.002","17.253","0.003","90","","92.43","0.03","90","","7187","2","120","2","120","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C57 H54 Cr2 Mn3 N27 O8 -","- C57 H71 Cr2 Mn3 N27 O8 -","- C228 H284 Cr8 Mn12 N108 O32 -","4","1","","Carmen Paraschiv; Marius Andruh; Yves Journaux; Zdirad Žak; Nathalie Kyritsakas; Louis Ricard","Trinuclear magnetic clusters based on cyanide metal complexes: synthesis, crystal structures, and magnetic properties of four new [Mn<small><sup>II</sup></small><small><sub>2</sub></small>M<small><sup>III</sup></small>] complexes (M = Cr, Fe, Co)","Journal of Materials Chemistry","2006","16","26","2660","","10.1039/b602055k","","","0.71073","MoKα","","0.0927","0.0744","","","0.1842","0.196","","","","","","1.073","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203314","9.7483","0.0002","11.5277","0.0003","11.6016","0.0003","68.5041","0.0011","86.9896","0.0011","78.3951","0.0012","1187.93","0.05","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H42 Cr Mn2 N13 O8 S -","- C37 H42 Cr Mn2 N13 O8 S -","- C37 H42 Cr Mn2 N13 O8 S -","1","0.5","","Carmen Paraschiv; Marius Andruh; Yves Journaux; Zdirad Žak; Nathalie Kyritsakas; Louis Ricard","Trinuclear magnetic clusters based on cyanide metal complexes: synthesis, crystal structures, and magnetic properties of four new [Mn<small><sup>II</sup></small><small><sub>2</sub></small>M<small><sup>III</sup></small>] complexes (M = Cr, Fe, Co)","Journal of Materials Chemistry","2006","16","26","2660","","10.1039/b602055k","","","0.71073","MoKα","","0.0687","0.056","","","0.1778","0.191","","","","","","1.168","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203315","23.478","0.005","13.805","0.005","17.086","0.005","90","","125.9","0.005","90","","4486","2","150","1","150","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","MnLFe(CN)6","","","- C37 H49 Fe Mn2 N13 O7.5 S -","- C37 H42 Fe Mn2 N13 O7.5 S -","- C148 H168 Fe4 Mn8 N52 O30 S4 -","4","0.5","","Carmen Paraschiv; Marius Andruh; Yves Journaux; Zdirad Žak; Nathalie Kyritsakas; Louis Ricard","Trinuclear magnetic clusters based on cyanide metal complexes: synthesis, crystal structures, and magnetic properties of four new [Mn<small><sup>II</sup></small><small><sub>2</sub></small>M<small><sup>III</sup></small>] complexes (M = Cr, Fe, Co)","Journal of Materials Chemistry","2006","16","26","2660","","10.1039/b602055k","","","0.71069","MoKα","","0.0506","0.0397","","","0.1053","0.1131","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203316","23.46","0.005","13.766","0.005","17.047","0.005","90","0.005","125.998","0.005","90","0.005","4454","2","150","0.1","150","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","MnLCo(CN)6","","","- C37 H49 Co Mn2 N13 O7.5 S -","- C37 H42 Co Mn2 N13 O7.5 S -","- C148 H168 Co4 Mn8 N52 O30 S4 -","4","0.5","","Carmen Paraschiv; Marius Andruh; Yves Journaux; Zdirad Žak; Nathalie Kyritsakas; Louis Ricard","Trinuclear magnetic clusters based on cyanide metal complexes: synthesis, crystal structures, and magnetic properties of four new [Mn<small><sup>II</sup></small><small><sub>2</sub></small>M<small><sup>III</sup></small>] complexes (M = Cr, Fe, Co)","Journal of Materials Chemistry","2006","16","26","2660","","10.1039/b602055k","","","0.71069","MoKα","","0.0518","0.0399","","","0.1064","0.1148","","","","","","1.052","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203325","19.9608","0.001","17.0907","0.0009","21.2188","0.0011","90","","96.983","0.001","90","","7185","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H48 Cl4 Cu4 N20 O28.13 -","- C52 H48 Cl4 Cu4 N20 O28.134 -","- C208 H192 Cl16 Cu16 N80 O112.536 -","4","1","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.71073","MoKα","","0.0434","0.038","","","0.1024","0.1081","","","","","","1.053","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203326","13.02","0.0009","14.0538","0.001","16.5587","0.0012","90","","100.253","0.001","90","","2981.5","0.4","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C48 H44 Mn4 N32 O6 -","- C48 H44 Mn4 N32 O6 -","- C96 H88 Mn8 N64 O12 -","2","1","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.71073","MoKα","","0.0948","0.0674","","","0.179","0.1962","","","","","","1.074","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203327","12.4058","0.0008","14.4617","0.001","22.1102","0.0015","72.629","0.001","80.747","0.001","78.257","0.001","3685.3","0.4","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C57 H54 F12 Mn4 N16 O20 S4 -","- C57 H54 F12 Mn4 N16 O20 S4 -","- C114 H108 F24 Mn8 N32 O40 S8 -","2","1","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.71069","MoKα","","0.055","0.0449","","","0.1192","0.1275","","","","","","1.031","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203328","22.912","0.009","21.105","0.007","18.184","0.007","90","","128.679","0.007","90","","6864","4","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H49 Cl4 Cu4 N31 O20 -","- C46 H49 Cl4 Cu4 N31 O20 -","- C184 H196 Cl16 Cu16 N124 O80 -","4","0.5","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.7107","MoKα","","0.1217","0.1101","","","0.2878","0.2986","","","","","","1.133","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203329","13.9992","0.0013","22.318","0.002","29.476","0.003","90","","93.573","0.002","90","","9191.4","1.5","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C81.5 H75 Cl4 Mn5 N25 O23.5 -","- C81.5 H73.5 Cl4 Mn5 N25 O23.5 -","- C326 H294 Cl16 Mn20 N100 O94 -","4","1","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.71073","MoKα","","0.1529","0.0745","","","0.1961","0.2436","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203330","16.8375","0.0019","23.483","0.003","23.61","0.003","90","","96.97","0.003","90","","9266","2","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H74 Cl4 Mn5 N42 O29 -","- C60 H60 Cl4 Mn5 N42 O29 -","- C240 H240 Cl16 Mn20 N168 O116 -","4","1","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.7107","MoKα","","0.1096","0.0979","","","0.2731","0.2906","","","","","","1.062","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203331","27.9255","0.0013","27.9255","0.0013","40.217","0.002","90","","90","","90","","31363","3","153","2","153","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","","- C102 H134 Mn9 N72 O58 -","- C102 H78 Mn9 N72 O58 -","- C816 H624 Mn72 N576 O464 -","8","0.25","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.7107","MoKα","","0.1356","0.1278","","","0.3008","0.3049","","","","","","1.348","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203332","20.9857","0.0014","20.9857","0.0014","17.3731","0.0012","90","","90","","90","","7651.1","0.9","153","2","153","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C102 H108.4 Cl10 Cu9 N66 O65.2 -","- C102 H82 Cl10 Cu9 N66 O65.2 -","- C204 H164 Cl20 Cu18 N132 O130.4 -","2","0.25","","Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.","Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties","Journal of Materials Chemistry","2006","16","26","2645","","10.1039/b602595a","","","0.7107","MoKα","","0.1127","0.1023","","","0.2406","0.2479","","","","","","1.254","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203333","13.0139","0.0004","16.3755","0.0005","15.3571","0.0005","90","","99.636","0.002","90","","3226.56","0.18","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H64 Co2 N4 O12 -","- C76 H52 Co2 N4 O12 -","- C152 H104 Co4 N8 O24 -","2","0.5","","Guillem Aromí; Helen Stoeckli-Evans; Simon J. Teat; Joan Cano; Joan Ribas","Di- and trinuclear Co<small><sup>II</sup></small> complexes of a bis-β-diketone ligand with variable conformation: structure and magnetic studies","Journal of Materials Chemistry","2006","16","26","2635","","10.1039/b602831d","","","0.6898","synchrotron","","0.0622","0.0445","","","0.1241","0.1338","","","","","","1.048","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203334","11.1277","0.0009","11.9911","0.0009","15.5385","0.0012","88.681","0.006","78.05","0.006","79.383","0.006","1993.5","0.3","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C94 H82 Co2 N6 O10 -","- C94 H82 Co2 N6 O10 -","- C94 H82 Co2 N6 O10 -","1","0.5","","Guillem Aromí; Helen Stoeckli-Evans; Simon J. Teat; Joan Cano; Joan Ribas","Di- and trinuclear Co<small><sup>II</sup></small> complexes of a bis-β-diketone ligand with variable conformation: structure and magnetic studies","Journal of Materials Chemistry","2006","16","26","2635","","10.1039/b602831d","","","0.71073","MoKα","","0.0638","0.0447","","","0.1152","0.1248","","","","","","1.035","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203335","14.979","0.004","15.001","0.004","16.832","0.008","110.075","0.009","106.062","0.009","106.923","0.007","3085.7","1.9","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C75 H54 Co3 O15 -","- C75 H42 Co3 O15 -","- C150 H84 Co6 O30 -","2","1","","Guillem Aromí; Helen Stoeckli-Evans; Simon J. Teat; Joan Cano; Joan Ribas","Di- and trinuclear Co<small><sup>II</sup></small> complexes of a bis-β-diketone ligand with variable conformation: structure and magnetic studies","Journal of Materials Chemistry","2006","16","26","2635","","10.1039/b602831d","","","0.6897","synchrotron","","0.1382","0.125","","","0.3631","0.3908","","","","","","1.735","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203336","22.8942","0.0001","22.8942","0.0001","22.8942","0.0001","90","","90","","90","","11999.9","0.09","123","2","123","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C42.5 H84 F3 Fe8 N4 O28 -","- C42.5 H81 F3 Fe8 N4 O28 -","- C340 H648 F24 Fe64 N32 O224 -","8","0.333333","","Jones, Leigh F.; Jensen, Paul; Moubaraki, Boujemaa; Berry, Kevin J.; Boas, John F.; Pilbrow, John R.; Murray, Keith S.","Heptanuclear iron(iii) triethanolamine clusters exhibiting ?millennium dome?-like topologies and an octanuclear analogue with ground spin states of S = 5/2 and 0, respectively","Journal of Materials Chemistry","2006","16","26","2690","","10.1039/b602858f","","","0.71073","MoKα","","0.0362","0.0285","","","0.0642","0.0674","","","","","","1.118","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203337","15.7648","0.0002","15.7648","0.0002","21.1873","0.0005","90","","90","","120","","4560.19","0.14","123","2","123","2","","","","","","","","5","P 3 1 c","P 3 -2c","159","","","","- C66 H132 Fe7 N3 O33 -","- C66 H123 Fe7 N3 O33 -","- C132 H246 Fe14 N6 O66 -","2","0.333333","","Jones, Leigh F.; Jensen, Paul; Moubaraki, Boujemaa; Berry, Kevin J.; Boas, John F.; Pilbrow, John R.; Murray, Keith S.","Heptanuclear iron(iii) triethanolamine clusters exhibiting ?millennium dome?-like topologies and an octanuclear analogue with ground spin states of S = 5/2 and 0, respectively","Journal of Materials Chemistry","2006","16","26","2690","","10.1039/b602858f","","","0.71073","MoKα","","0.093","0.0568","","","0.1179","0.1319","","","","","","1.026","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203338","15.5829","0.0008","15.5829","0.0008","20.893","0.001","90","","90","","120","","4393.7","0.4","123","2","123","2","","","","","","","","5","P 3 1 c","P 3 -2c","159","","","","- C63 H126 Fe7 N3 O33 -","- C63 H120 Fe7 N3 O33 -","- C126 H240 Fe14 N6 O66 -","2","0.333333","","Jones, Leigh F.; Jensen, Paul; Moubaraki, Boujemaa; Berry, Kevin J.; Boas, John F.; Pilbrow, John R.; Murray, Keith S.","Heptanuclear iron(iii) triethanolamine clusters exhibiting ?millennium dome?-like topologies and an octanuclear analogue with ground spin states of S = 5/2 and 0, respectively","Journal of Materials Chemistry","2006","16","26","2690","","10.1039/b602858f","","","0.71073","MoKα","","0.1324","0.0979","","","0.1623","0.1751","","","","","","1.124","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203351","11.7151","0.0007","12.8256","0.0008","13.0725","0.0008","95.35","0.001","111.716","0.001","116.379","0.001","1554.48","0.17","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H52 Fe N26 O2 S2 -","- C68 H48 Fe N26 O2 S2 -","- C68 H48 Fe N26 O2 S2 -","1","0.5","","Manuel Quesada; Maria Monrabal; Guillem Aromí; Víctor A. de la Peña-O'Shea; Martí Gich; Elies Molins; Olivier Roubeau; Simon J. Teat; Elizabeth J. MacLean; Patrick Gamez; Jan Reedijk","Spin transition in a triazine-based Fe(<small>II</small>) complex: variable-temperature structural, thermal, magnetic and spectroscopic studies","Journal of Materials Chemistry","2006","16","26","2669","","10.1039/b602903e","","","0.6923","synchrotron","","0.0566","0.0452","","","0.1268","0.1323","","","","","","1.065","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203352","11.666","0.0007","12.8283","0.0007","13.4211","0.0008","95.942","0.001","111.898","0.001","115.85","0.001","1589.67","0.16","250","2","250","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H52 Fe N26 O2 S2 -","- C68 H48 Fe N26 O2 S2 -","- C68 H48 Fe N26 O2 S2 -","1","0.5","","Manuel Quesada; Maria Monrabal; Guillem Aromí; Víctor A. de la Peña-O'Shea; Martí Gich; Elies Molins; Olivier Roubeau; Simon J. Teat; Elizabeth J. MacLean; Patrick Gamez; Jan Reedijk","Spin transition in a triazine-based Fe(<small>II</small>) complex: variable-temperature structural, thermal, magnetic and spectroscopic studies","Journal of Materials Chemistry","2006","16","26","2669","","10.1039/b602903e","","","0.6923","synchrotron","","0.0638","0.0477","","","0.1333","0.1412","","","","","","1.052","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203353","11.7103","0.0005","12.8096","0.0006","12.9408","0.0006","95.223","0.002","111.65","0.002","116.42","0.002","1537.99","0.13","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H52 Fe N26 O2 S2 -","- C68 H48 Fe N26 O2 S2 -","- C68 H48 Fe N26 O2 S2 -","1","0.5","","Manuel Quesada; Maria Monrabal; Guillem Aromí; Víctor A. de la Peña-O'Shea; Martí Gich; Elies Molins; Olivier Roubeau; Simon J. Teat; Elizabeth J. MacLean; Patrick Gamez; Jan Reedijk","Spin transition in a triazine-based Fe(<small>II</small>) complex: variable-temperature structural, thermal, magnetic and spectroscopic studies","Journal of Materials Chemistry","2006","16","26","2669","","10.1039/b602903e","","","0.6923","synchrotron","","0.0516","0.0434","","","0.1164","0.1206","","","","","","1.09","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203356","9.18","0.0016","9.2312","0.0016","9.2851","0.0017","115.971","0.003","96.663","0.003","110.403","0.002","628.39","0.19","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C20 H50 N5 Ta -","- C20 H50 N5 Ta -","- C20 H50 N5 Ta -","1","1","","Davies, Hywel O.; Jones, Anthony C.; McKinnell, Elizabeth A.; Raftery, James; Muryn, Christopher A.; Afzaal, Mohammad; O'Brien, Paul","Tantalum(v) diethylamide, [Ta(NEt2)5]: a potentially important and crystalline precursor for the CVD of oxides containing tantalum","Journal of Materials Chemistry","2006","16","23","2226","","10.1039/b602986h","","","0.71073","MoKα","","0.0379","0.0349","","","0.0872","0.0908","","","","","","1.086","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203357","9.454","0.005","4.905","0.005","15.495","0.005","90","","102.564","0.005","90","","701.3","0.8","173","2","173","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Copper Dimandelate","","","- C16 H14 Cu O6 -","- C16 H14 Cu O6 -","- C32 H28 Cu2 O12 -","2","0.5","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.71069","MoKα","","0.1293","0.0817","","","0.1216","0.1349","","","","","","1.16","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203358","7.988","0.001","8.998","0.001","9.029","0.001","90","","90","","90","","648.97","0.13","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 Mn O6 -","- C4 H6 Mn O6 -","- C16 H24 Mn4 O24 -","4","1","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.7107","MoKα","","0.0182","0.0176","","","0.0442","0.0444","","","","","","1.098","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203359","7.754","0.001","8.875","0.001","8.987","0.001","90","","90","","90","","618.46","0.13","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 Co O6 -","- C4 H6 Co O6 -","- C16 H24 Co4 O24 -","4","1","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.7107","MoKα","","0.0261","0.0227","","","0.0583","0.0605","","","","","","0.74","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203360","7.881","0.005","8.942","0.005","8.996","0.005","90","","90","","90","","634","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 Co0.37 Mn0.63 O6 -","- C4 H6 Co0.37 Mn0.63 O6 -","- C16 H24 Co1.48 Mn2.52 O24 -","4","1","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.71069","MoKα","","0.0177","0.0174","","","0.0425","0.0426","","","","","","1.109","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203361","7.86","0.001","8.923","0.001","8.984","0.001","90","","90","","90","","630.09","0.13","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 Fe O6 -","- C4 H6 Fe O6 -","- C16 H24 Fe4 O24 -","4","1","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.7107","MoKα","","0.0257","0.0241","","","0.0617","0.0626","","","","","","1.061","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203362","7.902","0.005","8.942","0.005","9.053","0.005","90","","90","","90","","639.7","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 Mn0.79 Ni0.21 O6 -","- C4 H6 Mn0.79 Ni0.21 O6 -","- C16 H24 Mn3.16 Ni0.84 O24 -","4","1","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.71069","MoKα","","0.0174","0.017","","","0.0478","0.048","","","","","","1.008","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203363","14.296","0.003","6.899","0.002","22.434","0.005","90","","119.66","0.05","90","","1922.7","1.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 Co O7 -","- C19 H22 Co O7 -","- C76 H88 Co4 O28 -","4","1","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.71069","MoKα","","0.1807","0.0946","","","0.1487","0.2014","","","","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203364","9.336","0.005","25.97","0.009","8.25","0.005","90","","106.045","0.005","90","","1922.3","1.7","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C19 H22 Cu O7 -","- C19 H22 Cu O7 -","- C76 H88 Cu4 O28 -","4","1","","Beghidja, Adel; Rogez, Guillaume; Rabu, Pierre; Welter, Richard; Drillon, Marc","An approach to chiral magnets using ?-hydroxycarboxylates","Journal of Materials Chemistry","2006","16","26","2715","","10.1039/b603014a","","","0.71069","MoKα","","0.1954","0.12","","","0.1728","0.2035","","","","","","1.166","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203365","7.864","0.004","8.054","0.004","9.893","0.005","70.04","0.05","73.31","0.05","83.69","0.05","564.1","0.5","294","2","294","2","","","","","","","","5","P 1","P 1","1","","","","- C26 H26 N2 O3 S -","- C26 H26 N2 O3 S -","- C26 H26 N2 O3 S -","1","1","","Blanca Ruiz; Zhou Yang; Volker Gramlich; Mojca Jazbinsek; Peter Günter","Synthesis and crystal structure of a new stilbazolium salt with large second-order optical nonlinearity","Journal of Materials Chemistry","2006","16","27","2839","","10.1039/b603049a","","","1.54178","CuKα","","0.215","0.1299","","","0.2828","0.3389","","","","","","0.622","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203366","13.6684","0.0004","7.4084","0.0002","23.4344","0.0008","90","","101.691","0.0012","90","","2323.76","0.12","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","2D-grid-FeSm","","","- C16 H18 Fe N8 O7 Sm -","- C16 H8 Fe N8 O7 Sm -","- C64 H32 Fe4 N32 O28 Sm4 -","4","1","","Zhang, Yuan-Zhu; Duan, Gong-Ping; Sato, Osamu; Gao, Song","Structures and magnetism of cyano-bridged grid-like two-dimensional 4f?3d arrays","Journal of Materials Chemistry","2006","16","26","2625","","10.1039/b603050e","","","0.71073","MoKα","","0.131","0.0739","","","0.1842","0.1987","","","","","","1.088","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203367","7.3467","0.0002","11.7325","0.0003","13.5919","0.0004","101.563","0.0016","90.6115","0.0017","92.7337","0.0012","1146.23","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","TbFe-2D","","","- C16 H18 Fe N8 O7 Tb -","- C16 H8 Fe N8 O7 Tb -","- C32 H16 Fe2 N16 O14 Tb2 -","2","1","","Zhang, Yuan-Zhu; Duan, Gong-Ping; Sato, Osamu; Gao, Song","Structures and magnetism of cyano-bridged grid-like two-dimensional 4f?3d arrays","Journal of Materials Chemistry","2006","16","26","2625","","10.1039/b603050e","","","0.71073","MoKα","","0.1326","0.0935","","","0.2335","0.2499","","","","","","1.004","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203381","15.8727","0.0007","8.3021","0.0004","16.7073","0.0007","90","","90.279","0.002","90","","2201.61","0.17","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 Br N Ni S6 -","- C20 H15 Br N Ni S6 -","- C80 H60 Br4 N4 Ni4 S24 -","4","1","","Belo, D.; Figueira, M. J.; Nunes, J. P. M.; Santos, I. C.; Pereira, L. C.; Gama, V.; Almeida, M.; Rovira, C.","Magnetic properties of RBzPy[Ni(?-tpdt)2] (R = H, Br, F): effects of cis?trans disorder","Journal of Materials Chemistry","2006","16","26","2746","","10.1039/b603443h","","","0.71073","MoKα","","0.0661","0.0388","","","0.0905","0.098","","","","","","1.036","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203382","10.428","0.0012","12.394","0.0006","16.594","0.0019","90","","90","","90","","2144.7","0.4","110","2","110","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H15 F N Ni S6 -","- C20 H15 F N Ni S6 -","- C80 H60 F4 N4 Ni4 S24 -","4","1","","Belo, D.; Figueira, M. J.; Nunes, J. P. M.; Santos, I. C.; Pereira, L. C.; Gama, V.; Almeida, M.; Rovira, C.","Magnetic properties of RBzPy[Ni(?-tpdt)2] (R = H, Br, F): effects of cis?trans disorder","Journal of Materials Chemistry","2006","16","26","2746","","10.1039/b603443h","","","0.71073","MoKα","","0.0858","0.0584","","","0.1303","0.1402","","","","","","0.99","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203383","14.914","0.0009","9.3981","0.0007","15.3174","0.001","90","","97.784","0.004","90","","2127.2","0.2","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 N Ni S6 -","- C20 H16 N Ni S6 -","- C80 H64 N4 Ni4 S24 -","4","1","","Belo, D.; Figueira, M. J.; Nunes, J. P. M.; Santos, I. C.; Pereira, L. C.; Gama, V.; Almeida, M.; Rovira, C.","Magnetic properties of RBzPy[Ni(?-tpdt)2] (R = H, Br, F): effects of cis?trans disorder","Journal of Materials Chemistry","2006","16","26","2746","","10.1039/b603443h","","","0.71073","MoKα","","0.0542","0.0369","","","0.0952","0.102","","","","","","1.045","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203384","17.2769","0.0013","10.7994","0.0008","17.8486","0.0014","90","","90","","90","","3330.2","0.4","193","2","193","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C13 H18 Cl2 Cu N5 O -","- C13 H18 Cl2 Cu N5 O -","- C104 H144 Cl16 Cu8 N40 O8 -","8","1","","Gilroy, Joe B.; Koivisto, Bryan D.; McDonald, Robert; Ferguson, Michael J.; Hicks, Robin G.","Magnetostructural studies of copper(ii)?verdazyl radical complexes","Journal of Materials Chemistry","2006","16","26","2618","","10.1039/b603624d","","","0.71073","MoKα","","0.0517","0.0488","","","0.1126","0.1137","","","","","","1.373","","","","has coordinates,has disorder","180364","2020-10-21","18:00:00",""
"7203385","14.9568","0.0012","9.9809","0.0008","17.3231","0.0014","90","","90","","90","","2586","0.4","193","2","193","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C9 H10 Cl2 Cu N5 O -","- C9 H10 Cl2 Cu N5 O -","- C72 H80 Cl16 Cu8 N40 O8 -","8","1","","Gilroy, Joe B.; Koivisto, Bryan D.; McDonald, Robert; Ferguson, Michael J.; Hicks, Robin G.","Magnetostructural studies of copper(ii)?verdazyl radical complexes","Journal of Materials Chemistry","2006","16","26","2618","","10.1039/b603624d","","","0.71073","MoKα","","0.0269","0.023","","","0.0626","0.0656","","","","","","1.077","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203386","5.1997","0.0013","26.482","0.007","10.429","0.003","90","","103.785","0.004","90","","1394.7","0.6","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,5-diisopropyl-3-(2-pyridyl)-6-oxoverdazyl","","- C13 H18 N5 O -","- C13 H18 N5 O -","- C52 H72 N20 O4 -","4","1","","Gilroy, Joe B.; Koivisto, Bryan D.; McDonald, Robert; Ferguson, Michael J.; Hicks, Robin G.","Magnetostructural studies of copper(ii)?verdazyl radical complexes","Journal of Materials Chemistry","2006","16","26","2618","","10.1039/b603624d","","","0.71073","MoKα","","0.1148","0.0524","","","0.0993","0.1187","","","","","","1.015","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203387","9.811","0.0009","10.9073","0.001","12.5202","0.0012","78.5653","0.0014","83.4835","0.0014","73.6999","0.0014","1258","0.2","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H13 Cu F12 N6 O5 -","- C18 H13 Cu F12 N6 O5 -","- C36 H26 Cu2 F24 N12 O10 -","2","1","","Gilroy, Joe B.; Koivisto, Bryan D.; McDonald, Robert; Ferguson, Michael J.; Hicks, Robin G.","Magnetostructural studies of copper(ii)?verdazyl radical complexes","Journal of Materials Chemistry","2006","16","26","2618","","10.1039/b603624d","","","0.71073","MoKα","","0.0636","0.0453","","","0.1207","0.1302","","","","","","1.072","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203400","14.695","0.002","13.33","0.0014","41.182","0.005","90","","94.32","0.01","90","","8044","1.7","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","2-(4-tert-Butylphenyl)-5-(4-(9,9-dihexyl-2-(trimethylsilyl)- fluoren-7-yl)phenyl)-1,3,4-oxadiazole","2-(4-tert-Butylphenyl)-5-{4-[9,9-dihexyl-2-(trimethylsilyl)-fluoren-7- yl]phenyl}-1,3,4-oxadiazole","","- C46 H58 N2 O Si -","- C46 H58 N2 O Si -","- C368 H464 N16 O8 Si8 -","8","1","","Kamtekar, Kiran T.; Wang, Changsheng; Bettington, Sylvia; Batsanov, Andrei S.; Perepichka, Igor F.; Bryce, Martin R.; Ahn, Jin H.; Rabinal, Mohammad; Petty, Michael C.","New electroluminescent bipolar compounds for balanced charge-transport and tuneable colour in organic light emitting diodes: triphenylamine?oxadiazole?fluorene triad molecules","Journal of Materials Chemistry","2006","16","39","3823","","10.1039/b604543j","","","0.71073","MoKα","","0.0911","0.0447","","","0.1001","0.1178","","","","","","0.938","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203401","10.945","0.005","12.714","0.003","13.128","0.004","96.1","0.01","93.84","0.01","94.38","0.01","1806","1.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","2-(4-tert-Butylphenyl)-5-(4-(9,9-dihexyl-2-bromofluoren-7- yl)phenyl)-1,3,4-oxadiazole","2-(4-tert-Butylphenyl)-5-[4-(9,9-dihexyl-2-bromofluoren-7- yl)phenyl]-1,3,4-oxadiazole","","- C43 H49 Br N2 O -","- C43 H49 Br N2 O -","- C86 H98 Br2 N4 O2 -","2","1","","Kamtekar, Kiran T.; Wang, Changsheng; Bettington, Sylvia; Batsanov, Andrei S.; Perepichka, Igor F.; Bryce, Martin R.; Ahn, Jin H.; Rabinal, Mohammad; Petty, Michael C.","New electroluminescent bipolar compounds for balanced charge-transport and tuneable colour in organic light emitting diodes: triphenylamine?oxadiazole?fluorene triad molecules","Journal of Materials Chemistry","2006","16","39","3823","","10.1039/b604543j","","","0.71073","MoKα","","0.0518","0.0351","","","0.0888","0.0937","","","","","","1.032","","","","has coordinates,has disorder","180365","2020-10-21","18:00:00",""
"7203402","21.462","0.006","9.581","0.003","23.428","0.006","90","","96.48","0.02","90","","4787","2","120","2","120","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","2,5-Bis(2-(4-diphenylaminophenyl)-1,3,4-oxadiazol-5- yl)pyridine, deuterochloroform trisolvate","2,5-Bis[2-(4-diphenylaminophenyl)-1,3,4-oxadiazol-5- yl]pyridine, deuterochloroform trisolvate","","- C48 H31 Cl9 D3 N7 O2 -","- C48 H31 Cl9 D3 N7 O2 -","- C192 H124 Cl36 D12 N28 O8 -","4","0.5","","Kamtekar, Kiran T.; Wang, Changsheng; Bettington, Sylvia; Batsanov, Andrei S.; Perepichka, Igor F.; Bryce, Martin R.; Ahn, Jin H.; Rabinal, Mohammad; Petty, Michael C.","New electroluminescent bipolar compounds for balanced charge-transport and tuneable colour in organic light emitting diodes: triphenylamine?oxadiazole?fluorene triad molecules","Journal of Materials Chemistry","2006","16","39","3823","","10.1039/b604543j","","","0.71073","MoKα","","0.0648","0.0547","","","0.1607","0.1656","","","","","","1.681","","","","has coordinates,has disorder","180365","2020-10-21","18:00:00",""
"7203403","7.3569","0.0011","6.1392","0.001","34.909","0.006","90","","91.43","0.02","90","","1576.2","0.4","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-(4-tert-butylphenyl)-5-(4-bromophenyl)-1,3,4-oxadiazole","2-(4-tert-butylphenyl)-5-(4-bromophenyl)-1,3,4-oxadiazole","","- C18 H17 Br N2 O -","- C18 H17 Br N2 O -","- C72 H68 Br4 N8 O4 -","4","1","","Kamtekar, Kiran T.; Wang, Changsheng; Bettington, Sylvia; Batsanov, Andrei S.; Perepichka, Igor F.; Bryce, Martin R.; Ahn, Jin H.; Rabinal, Mohammad; Petty, Michael C.","New electroluminescent bipolar compounds for balanced charge-transport and tuneable colour in organic light emitting diodes: triphenylamine?oxadiazole?fluorene triad molecules","Journal of Materials Chemistry","2006","16","39","3823","","10.1039/b604543j","","","0.71073","MoKα","","0.0832","0.076","","","0.1678","0.171","","","","","","1.158","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203410","32.361","0.001","8.8752","0.0004","21.1416","0.0005","90","","118.26","0.002","90","","5348.3","0.3","218","2","218","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H34 Co2 F24 N8 O12 -","- C40 H34 Co2 F24 N8 O12 -","- C160 H136 Co8 F96 N32 O48 -","4","0.5","","Catala, Laure; Wurst, Klaus; Amabilino, David B.; Veciana, Jaume","Polymorphs of a pyrazole nitronyl nitroxide and its complexes with metal(ii) hexafluoroacetylacetonates","Journal of Materials Chemistry","2006","16","26","2736","","10.1039/b604598g","","","0.71073","MoKα","","0.0492","0.0368","","","0.0874","0.0928","","","","","","1.042","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203411","13.111","0.003","13.153","0.004","13.664","0.004","95.901","0.008","110.85","0.01","103.85","0.01","2091.6","1","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C30.5 H32.5 Cl1.5 F12 N8 Ni O8 -","- C30.5 H32 Cl1.5 F12 N8 Ni O8 -","- C61 H64 Cl3 F24 N16 Ni2 O16 -","2","1","","Catala, Laure; Wurst, Klaus; Amabilino, David B.; Veciana, Jaume","Polymorphs of a pyrazole nitronyl nitroxide and its complexes with metal(ii) hexafluoroacetylacetonates","Journal of Materials Chemistry","2006","16","26","2736","","10.1039/b604598g","","","0.71073","MoKα","","0.2209","0.0922","","","0.1718","0.2124","","","","","","0.976","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203412","13.8867","0.0004","13.1057","0.0003","13.4309","0.0004","90","","105.917","0.001","90","","2350.64","0.11","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H15 N4 O2 -","- C10 H15 N4 O2 -","- C80 H120 N32 O16 -","8","2","","Catala, Laure; Wurst, Klaus; Amabilino, David B.; Veciana, Jaume","Polymorphs of a pyrazole nitronyl nitroxide and its complexes with metal(ii) hexafluoroacetylacetonates","Journal of Materials Chemistry","2006","16","26","2736","","10.1039/b604598g","","","0.71073","MoKα","","0.0425","0.0343","","","0.0866","0.0908","","","","","","1.035","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203413","13.2125","0.0007","10.9602","0.0006","22.4329","0.0011","90","","95.053","0.001","90","","3235.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H106 Mn4 N4 O16 -","- C52 H106 Mn4 N4 O16 -","- C104 H212 Mn8 N8 O32 -","2","0.5","","Ayuk M. Ako; Valeriu Mereacre; Ian J. Hewitt; Rodolphe Clérac; Lollita Lecren; Christopher E. Anson; Annie K. Powell","Enhancing single molecule magnet parameters. Synthesis, crystal structures and magnetic properties of mixed-valent Mn<small><sub>4</sub></small> SMMs","Journal of Materials Chemistry","2006","16","26","2579","","10.1039/b604611h","","","0.71073","MoKα","","0.0357","0.0278","","","0.0721","0.074","","","","","","0.973","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203414","16.6894","0.0014","8.736","0.0007","21.3378","0.0018","90","","92.949","0.002","90","","3106.9","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H88 Mn4 N4 O16 -","- C60 H88 Mn4 N4 O16 -","- C120 H176 Mn8 N8 O32 -","2","0.5","","Ayuk M. Ako; Valeriu Mereacre; Ian J. Hewitt; Rodolphe Clérac; Lollita Lecren; Christopher E. Anson; Annie K. Powell","Enhancing single molecule magnet parameters. Synthesis, crystal structures and magnetic properties of mixed-valent Mn<small><sub>4</sub></small> SMMs","Journal of Materials Chemistry","2006","16","26","2579","","10.1039/b604611h","","","0.71073","MoKα","","0.0559","0.0416","","","0.0949","0.1001","","","","","","1.012","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203415","30.242","0.003","8.671","0.0006","26.618","0.003","90","","119.915","0.009","90","","6050","1.1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H75.9 Mn4 N4.7 O20.3 -","- C54 H75.3 Mn4 N4.7 O20.3 -","- C216 H301.2 Mn16 N18.8 O81.2 -","4","0.5","","Ayuk M. Ako; Valeriu Mereacre; Ian J. Hewitt; Rodolphe Clérac; Lollita Lecren; Christopher E. Anson; Annie K. Powell","Enhancing single molecule magnet parameters. Synthesis, crystal structures and magnetic properties of mixed-valent Mn<small><sub>4</sub></small> SMMs","Journal of Materials Chemistry","2006","16","26","2579","","10.1039/b604611h","","","0.71073","MoKα","","0.1091","0.0904","","","0.2279","0.2397","","","","","","1.091","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203420","10.356","0.004","13.044","0.005","19.594","0.007","97.79","0.008","104.678","0.008","99.573","0.009","2480.6","1.6","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C63 H53 Cl3 Si2 -","- C63 H53 Cl3 Si2 -","- C126 H106 Cl6 Si4 -","2","1","","Xiaowei Zhan; Chad Risko; Alexander Korlyukov; Francis Sena; Tatiana V. Timofeeva; Mikhail Yu. Antipin; Stephen Barlow; Jean-Luc Brédas; Seth R. Marder","Comparative studies of the geometric and electronic properties of 1,1-disubstituted-2,3,4,5-tetraphenylsiloles and 1,1,2,2-tetramethyl-3,4,5,6-tetraphenyl-1,2-disila-3,5-cyclohexadiene","Journal of Materials Chemistry","2006","16","39","3814","","10.1039/b605343b","","","0.71073","MoKα","","0.2242","0.0704","","","0.126","0.1509","","","","","","0.94","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203421","27.005","0.007","16.153","0.007","16.336","0.005","90","","93.294","0.01","90","","7114","4","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H26 O2 Si -","- C30 H26 O2 Si -","- C360 H312 O24 Si12 -","12","1.5","","Xiaowei Zhan; Chad Risko; Alexander Korlyukov; Francis Sena; Tatiana V. Timofeeva; Mikhail Yu. Antipin; Stephen Barlow; Jean-Luc Brédas; Seth R. Marder","Comparative studies of the geometric and electronic properties of 1,1-disubstituted-2,3,4,5-tetraphenylsiloles and 1,1,2,2-tetramethyl-3,4,5,6-tetraphenyl-1,2-disila-3,5-cyclohexadiene","Journal of Materials Chemistry","2006","16","39","3814","","10.1039/b605343b","","","0.71073","MoKα","","0.103","0.0547","","","0.1065","0.1182","","","","","","1.014","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203422","9.782","0.002","22.465","0.006","12.753","0.003","90","","99.581","0.019","90","","2763.4","1.1","153","2","153","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H32 Si2 -","- C32 H32 Si2 -","- C128 H128 Si8 -","4","1","","Xiaowei Zhan; Chad Risko; Alexander Korlyukov; Francis Sena; Tatiana V. Timofeeva; Mikhail Yu. Antipin; Stephen Barlow; Jean-Luc Brédas; Seth R. Marder","Comparative studies of the geometric and electronic properties of 1,1-disubstituted-2,3,4,5-tetraphenylsiloles and 1,1,2,2-tetramethyl-3,4,5,6-tetraphenyl-1,2-disila-3,5-cyclohexadiene","Journal of Materials Chemistry","2006","16","39","3814","","10.1039/b605343b","","","0.71073","MoKα","","0.0563","0.0364","","","0.0875","0.1013","","","","","","0.991","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203423","7.191","0.003","35.436","0.014","13.048","0.005","90","","90","","90","","3325","2","293","","293","","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C16 H8 Br4 Cl4 Fe S4 Se8 -","- C16 H8 Br4 Cl4 Fe S4 Se8 -","- C64 H32 Br16 Cl16 Fe4 S16 Se32 -","4","0.25","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.163","0.0621","","","0.1555","0.2128","","","","","","0.796","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203424","7.205","0.003","35.506","0.015","13.063","0.005","90","","90","","90","","3342","2","293","","293","","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C16 H8 Br4 Cl4 Ga S4 Se8 -","- C16 H8 Br4 Cl4 Ga S4 Se8 -","- C64 H32 Br16 Cl16 Ga4 S16 Se32 -","4","0.25","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.1431","0.0653","","","0.1541","0.2009","","","","","","0.789","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203425","38.489","0.013","7.207","0.002","13.08","0.004","90","","109.405","0.008","90","","3422.2","1.8","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H8 Br8 Fe S4 Se8 -","- C16 H8 Br8 Fe S4 Se8 -","- C64 H32 Br32 Fe4 S16 Se32 -","4","0.5","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.1495","0.0614","","","0.1518","0.1884","","","","","","0.895","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203426","38.506","0.011","7.214","0.002","13.084","0.004","90","","109.567","0.006","90","","3424.6","1.7","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H8 Br8 Ga S4 Se8 -","- C16 H8 Br8 Ga S4 Se8 -","- C64 H32 Br32 Ga4 S16 Se32 -","4","0.5","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.1404","0.075","","","0.249","0.269","","","","","","1.081","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203427","7.3104","0.0015","35.755","0.008","13.552","0.003","90","","90","","90","","3542.3","1.3","293","","293","","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C16 H8 Cl4 Fe I4 S4 Se8 -","- C16 H8 Cl4 Fe I4 S4 Se8 -","- C64 H32 Cl16 Fe4 I16 S16 Se32 -","4","0.25","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.0567","0.0385","","","0.1045","0.1266","","","","","","1.061","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203428","7.313","0.003","35.766","0.013","13.558","0.005","90","","90","","90","","3546","2","293","","293","","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C16 H8 Cl4 Ga I4 S4 Se8 -","- C16 H8 Cl4 Ga I4 S4 Se8 -","- C64 H32 Cl16 Ga4 I16 S16 Se32 -","4","0.25","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.1263","0.064","","","0.1482","0.1831","","","","","","0.86","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203429","7.317","0.002","36.582","0.012","13.569","0.004","90","","90","","90","","3632","1.9","293","","293","","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C16 H8 Br4 Fe I4 S4 Se8 -","- C16 H8 Br4 Fe I4 S4 Se8 -","- C64 H32 Br16 Fe4 I16 S16 Se32 -","4","0.25","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.0913","0.0534","","","0.126","0.1552","","","","","","1.007","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203430","7.3241","0.0017","36.602","0.009","13.58","0.003","90","","90","","90","","3640.5","1.5","293","","293","","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C16 H8 Br4 Fe I4 S4 Se8 -","- C16 H8 Br4 Fe I4 S4 Se8 -","- C64 H32 Br16 Fe4 I16 S16 Se32 -","4","0.25","","Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro","New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2006","16","33","3381","","10.1039/b605420j","","","0.71073","MoKα","","0.0678","0.0416","","","0.1159","0.137","","","","","","0.913","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203431","16.0034","0.0009","33.0383","0.0007","10.6224","0.0005","90","","97.142","0.002","90","","5572.8","0.4","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","3,6-Bis-(2,5-bis-hexyloxy-4-phenylethynyl-phenylethynyl)- fluoren-9-one","","","- C69 H72 O5 -","- C69 H72 O5 -","- C276 H288 O20 -","4","0.5","","Matthias Lehmann; Shin-Woong Kang; Christiane Köhn; Sönke Haseloh; Ute Kolb; Dieter Schollmeyer; QingBing Wang; Satyendra Kumar","Shape-persistent V-shaped mesogens—formation of nematic phases with biaxial order","Journal of Materials Chemistry","2006","16","44","4326","","10.1039/b605718g","","","1.54178","CuKα","","0.059","0.0453","","","0.1119","0.1207","","","","","","1.026","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203467","13.104","0.005","25.175","0.009","16.573","0.006","90","","99.814","0.007","90","","5387","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C108 H94 Mn6 N8 O30 P4 -","- C108 H94 Mn6 N8 O30 P4 -","- C216 H188 Mn12 N16 O60 P8 -","2","0.5","","Shanmugam, Maheswaran; Shanmugam, Muralidharan; Chastanet, Guillaume; Sessoli, Roberta; Mallah, Talal; Wernsdorfer, Wolfgang; Winpenny, Richard E. P.","Minor changes in phosphonate ligands lead to new hexa- and dodeca-nuclear Mn clusters","Journal of Materials Chemistry","2006","16","26","2576","","10.1039/b606571f","","","0.71073","MoKα","","0.0673","0.0383","","","0.0758","0.0811","","","","","","0.864","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203468","25.261","0.016","25.341","0.016","28.763","0.017","71.536","0.013","80.221","0.012","83.453","0.012","17175","18","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C161.63 H147.88 Li Mn12 N9.13 O50.38 P4 -","- C161.625 H147.875 Li Mn12 N9.125 O50.375 P4 -","- C646.5 H591.5 Li4 Mn48 N36.5 O201.5 P16 -","4","2","","Shanmugam, Maheswaran; Shanmugam, Muralidharan; Chastanet, Guillaume; Sessoli, Roberta; Mallah, Talal; Wernsdorfer, Wolfgang; Winpenny, Richard E. P.","Minor changes in phosphonate ligands lead to new hexa- and dodeca-nuclear Mn clusters","Journal of Materials Chemistry","2006","16","26","2576","","10.1039/b606571f","","","0.71073","MoKα","","0.1483","0.0598","","","0.1325","0.1582","","","","","","0.772","","","","has coordinates,has disorder","180365","2020-10-21","18:00:00",""
"7203477","5.0294","0.0011","7.4771","0.0017","19.701","0.004","97.683","0.004","92.558","0.004","109.44","0.004","689.2","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H30 O6 -","- C36 H30 O6 -","- C36 H30 O6 -","1","0.5","","Rüdiger Schmidt; Silke Göttling; Dirk Leusser; Dietmar Stalke; Ana-Maria Krause; Frank Würthner","Highly soluble acenes as semiconductors for thin film transistors","Journal of Materials Chemistry","2006","16","37","3708","","10.1039/b607172d","","","0.71073","MoKα","","0.0649","0.0516","","","0.126","0.1326","","","","","","1.084","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203478","35.241","0.003","5.6021","0.0005","20.1942","0.0018","90","","90.868","0.002","90","","3986.4","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H34 Cl6 O6 -","- C42 H34 Cl6 O6 -","- C168 H136 Cl24 O24 -","4","1","","Rüdiger Schmidt; Silke Göttling; Dirk Leusser; Dietmar Stalke; Ana-Maria Krause; Frank Würthner","Highly soluble acenes as semiconductors for thin film transistors","Journal of Materials Chemistry","2006","16","37","3708","","10.1039/b607172d","","","0.71073","MoKα","","0.0599","0.0544","","","0.1117","0.1138","","","","","","1.236","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203503","18.217","0.006","18.217","0.006","24.865","0.007","90","","90","","120","","7146","4","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C42 H24 Fe4 N6 O S12 -","- C42 H24 Fe4 N6 O S12 -","- C252 H144 Fe24 N36 O6 S72 -","6","0.333333","","Jian, Fangfang; Xiao, Hailian; Bai, Zhengshuai; Zhao, Pusu","Synthesis, characterization and nonlinear optical effects of M4(?4-O) core complexes with large two-photon absorption cross-section","Journal of Materials Chemistry","2006","16","38","3746","","10.1039/b607731e","","","0.71073","MoKα","","0.1167","0.0755","","","0.1298","0.1483","","","","","","1.023","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203504","18.264","0.003","18.264","0.003","24.878","0.005","90","","90","","120","","7187","2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C42 H24 Co4 N6 O S12 -","- C42 H24 Co4 N6 O S12 -","- C252 H144 Co24 N36 O6 S72 -","6","0.333333","","Jian, Fangfang; Xiao, Hailian; Bai, Zhengshuai; Zhao, Pusu","Synthesis, characterization and nonlinear optical effects of M4(?4-O) core complexes with large two-photon absorption cross-section","Journal of Materials Chemistry","2006","16","38","3746","","10.1039/b607731e","","","0.71073","MoKα","","0.1131","0.0423","","","0.0681","0.082","","","","","","0.982","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203505","18.261","0.003","18.261","0.003","24.862","0.005","90","","90","","120","","7180","2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C42 H24 N6 Ni4 O S12 -","- C42 H24 N6 Ni4 O S12 -","- C252 H144 N36 Ni24 O6 S72 -","6","0.333333","","Jian, Fangfang; Xiao, Hailian; Bai, Zhengshuai; Zhao, Pusu","Synthesis, characterization and nonlinear optical effects of M4(?4-O) core complexes with large two-photon absorption cross-section","Journal of Materials Chemistry","2006","16","38","3746","","10.1039/b607731e","","","0.71073","MoKα","","0.1551","0.0955","","","0.1798","0.2095","","","","","","1.028","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203512","10.093972","0.000026","10.093972","","10.093972","","90","","90","","90","","1028.46","0.003","","","","","","","","","","","Synthetic","3","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- O7 Ti1.99 Y1.98 -","- O7 Ti1.994 Y1.9766 -","- O56 Ti15.952 Y15.8128 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","3.67","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203513","10.11355","0.000026","10.11355","","10.11355","","90","","90","","90","","1034.45","0.003","","","","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.1 O7 Ti2 Y1.9 -","- La0.1 O7 Ti2 Y1.9 -","- La0.8 O56 Ti16 Y15.2 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","3.54","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203514","10.13428","0.00004","10.13428","","10.13428","","90","","90","","90","","1040.83","0.004","","","298","","","","101.325","","","","synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.22 O7 Ti2 Y1.75 -","- La0.2185 O7 Ti2 Y1.7497 -","- La1.748 O56 Ti16 Y13.9976 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","neutron","","TOFneutrons","","","","","","","","","","","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203515","7.76154","0.00025","5.51328","0.00018","13.0011","0.0006","90","","98.597","0.013","90","","550.09","0.04","","","298","","","","101.325","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.61 O7 Ti2 Y0.35 -","- La1.6058 O7 Ti2 Y0.3482 -","- La6.4232 O28 Ti8 Y1.3928 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","neutron","","TOF,ISIS,RAL","","","","","","","","","","","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203516","10.13077","0.00005","10.13077","","10.13077","","90","","90","","90","","1039.75","0.005","","","298","","","","101.325","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.22 O7 Ti2 Y1.75 -","- La0.2207 O7 Ti2 Y1.7471 -","- La1.7656 O56 Ti16 Y13.9768 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","neutron","","TOF,ISIS,RAL","","","","","","","","","","","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203517","7.7865","0.00022","5.53083","0.00015","13.0051","0.0006","90","","98.617","0.012","90","","553.75","0.04","","","","","","","","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.85 O7 Ti2 Y0.15 -","- La1.85 O7 Ti2 Y0.15 -","- La7.4 O28 Ti8 Y0.6 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","1.64","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203518","10.1347","0.0008","10.1347","","10.1347","","90","","90","","90","","1040.96","0.08","","","298","","","","101.325","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.23 O7 Ti2 Y1.73 -","- La0.2273 O7 Ti2 Y1.7275 -","- La1.8184 O56 Ti16 Y13.82 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","neutron","","TOF,ISIS,RAL","","","","","","","","","","","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203519","7.80068","0.00021","5.54031","0.00014","13.0072","0.0005","90","","98.633","0.012","90","","555.78","0.03","","","","","","","","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.95 O7 Ti2 Y0.05 -","- La1.95 O7 Ti2 Y0.05 -","- La7.8 O28 Ti8 Y0.2 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","1.41","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203520","7.80896","0.0001","5.54608","0.00007","13.01425","0.00022","90","","98.658","0.004","90","","557.213","0.015","","","","","","","","","","","Synthetic","3","P 1 21 1","P 2yb","4","Lanthanum Titanate","Lanthanum Titanate","","- La1.94 O7 Ti2.07 -","- La1.94416 O7 Ti2.07313 -","- La7.77664 O28 Ti8.29252 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","2.19","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203521","10.10199","0.00011","10.10199","","10.10199","","90","","90","","90","","1030.91","0.011","","","","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.05 O7 Ti2 Y1.95 -","- La0.05 O7 Ti2 Y1.95 -","- La0.4 O56 Ti16 Y15.6 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.8","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203522","10.10484","0.00012","10.10484","","10.10484","","90","","90","","90","","1031.78","0.012","","","","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.1 O7 Ti2 Y1.9 -","- La0.1 O7 Ti2 Y1.9 -","- La0.8 O56 Ti16 Y15.2 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.79","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203523","10.10901","0.00004","10.10901","","10.10901","","90","","90","","90","","1033.06","0.004","","","","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.2 O7 Ti2 Y1.8 -","- La0.2 O7 Ti2 Y1.8 -","- La1.6 O56 Ti16 Y14.4 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.79","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203524","10.11306","0.00006","10.11306","","10.11306","","90","","90","","90","","1034.3","0.006","","","","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.25 O7 Ti2 Y1.75 -","- La0.25 O7 Ti2 Y1.75 -","- La2 O56 Ti16 Y14 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.85","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203525","10.11981","0.00006","10.11981","","10.11981","","90","","90","","90","","1036.38","0.006","","","","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.3 O7 Ti2 Y1.7 -","- La0.3 O7 Ti2 Y1.7 -","- La2.4 O56 Ti16 Y13.6 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.84","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203526","10.12344","0.00006","10.12344","","10.12344","","90","","90","","90","","1037.49","0.006","","","","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La0.35 O7 Ti2 Y1.65 -","- La0.35 O7 Ti2 Y1.65 -","- La2.8 O56 Ti16 Y13.2 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.82","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203527","7.77611","0.00019","5.52192","0.00014","13.0062","0.0004","90","","98.573","0.009","90","","552.23","0.03","","","298","","","","101.325","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.65 O7 Ti2 Y0.35 -","- La1.65 O7 Ti2 Y0.35 -","- La6.6 O28 Ti8 Y1.4 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","x-ray","1.54058","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203528","10.1315","0.0004","10.1315","","10.1315","","90","","90","","90","","1039.97","0.04","","","298","","","","101.325","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La1.65 O7 Ti2 Y0.35 -","- La1.65 O7 Ti2 Y0.35 -","- La13.2 O56 Ti16 Y2.8 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","x-ray","1.54058","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203529","7.77648","0.00025","5.52235","0.00018","13.0065","0.0005","90","","98.628","0.007","90","","552.24","0.03","","","298","","","","101.325","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.7 O7 Ti2 Y0.3 -","- La1.7 O7 Ti2 Y0.3 -","- La6.8 O28 Ti8 Y1.2 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","x-ray","1.54058","CuKα~1~","","","","","","","","","","0.9","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203530","10.1316","0.0011","10.1316","","10.1316","","90","","90","","90","","1040","0.11","","","298","","","","101.325","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La1.7 O7 Ti2 Y0.3 -","- La1.7 O7 Ti2 Y0.3 -","- La13.6 O56 Ti16 Y2.4 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","x-ray","1.54058","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203531","7.7756","0.0004","5.52257","0.00027","13.0015","0.0007","90","","98.586","0.009","90","","552.04","0.05","","","298","","","","101.325","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.75 O7 Ti2 Y0.25 -","- La1.75 O7 Ti2 Y0.25 -","- La7 O28 Ti8 Y -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","x-ray","1.54058","CuKα~1~","","","","","","","","","","0.9","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203532","10.1145","0.0024","10.1145","","10.1145","","90","","90","","90","","1034.7","0.2","","","298","","","","101.325","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La1.75 O7 Ti2 Y0.25 -","- La1.75 O7 Ti2 Y0.25 -","- La14 O56 Ti16 Y2 -","8","0.0416667","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","x-ray","1.54058","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203533","7.7821","0.0004","5.52664","0.00025","13.0058","0.0007","90","","98.62","0.01","90","","553.05","0.05","","","","","","","","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.8 O7 Ti2 Y0.2 -","- La1.8 O7 Ti2 Y0.2 -","- La7.2 O28 Ti8 Y0.8 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.88","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203534","7.7889","0.0004","5.53193","0.00026","13.0091","0.0009","90","","98.649","0.019","90","","554.16","0.06","","","","","","","","","","","Synthetic","4","P 1 21 1","P 2yb","4","Yttrium Lanthanum Titanate","Yttrium Lanthanum Titanate","","- La1.85 O7 Ti2 Y0.15 -","- La1.85 O7 Ti2 Y0.15 -","- La7.4 O28 Ti8 Y0.6 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.85","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203535","7.7953","0.0004","5.53702","0.00028","13.0114","0.0009","90","","98.626","0.018","90","","555.25","0.06","","","","","","","","","","","Synthetic","4","P 1 21 1","P 2yb","4","Lanthanum Yttrium Titanate","Lanthanum Yttrium Titanate","","- La1.95 O7 Ti2 Y0.05 -","- La1.95 O7 Ti2 Y0.05 -","- La7.8 O28 Ti8 Y0.2 -","4","2","","Harvey, Elizabeth J.; Ashbrook, Sharon E.; Lumpkin, Gregory R.; Redfern, Simon A. T.","Characterisation of the (Y1?xLax)2Ti2O7 system by powder diffraction and nuclear magnetic resonance methods","Journal of Materials Chemistry","2006","16","48","4665","","10.1039/b608053g","powder diffraction","","","","","","","","","","","","","0.85","","","","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203537","11.125","0.002","16.094","0.01","18.37","0.009","77.92","0.05","87.2","0.02","89.6","0.03","3212","3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H40 F5 N O4 Pd -","- C32 H40 F5 N O4 Pd -","- C128 H160 F20 N4 O16 Pd4 -","4","2","","Viorel Cîrcu; Timothy J. K. Gibbs; Laurent Omnès; Peter N. Horton; Michael B. Hursthouse; Duncan W. Bruce","Orthometallated palladium(<small>II</small>) imine complexes as candidate materials for the biaxial nematic phase. Crystal and molecular structure of three palladium imine complexes","Journal of Materials Chemistry","2006","16","44","4316","","10.1039/b608823f","","","0.71073","MoKα","","0.2395","0.1328","","","0.3342","0.387","","","","","","1.144","","","","has coordinates,has disorder","180366","2020-10-21","18:00:00",""
"7203538","7.2597","0.0003","16.848","0.002","27.261","0.003","90","","90","","90","","3334.3","0.6","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C40 H44 F N O3 Pd -","- C40 H44 F N O3 Pd -","- C160 H176 F4 N4 O12 Pd4 -","4","1","","Viorel Cîrcu; Timothy J. K. Gibbs; Laurent Omnès; Peter N. Horton; Michael B. Hursthouse; Duncan W. Bruce","Orthometallated palladium(<small>II</small>) imine complexes as candidate materials for the biaxial nematic phase. Crystal and molecular structure of three palladium imine complexes","Journal of Materials Chemistry","2006","16","44","4316","","10.1039/b608823f","","","0.71073","MoKα","","0.0258","0.0232","","","0.0528","0.0537","","","","","","1.039","","","","has coordinates,has disorder","180366","2020-10-21","18:00:00",""
"7203539","17.801","0.004","16.966","0.003","22.192","0.005","90","","98.646","0.013","90","","6626","2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H45 N O2 Pd -","- C40 H45 N O2 Pd -","- C320 H360 N8 O16 Pd8 -","8","2","","Viorel Cîrcu; Timothy J. K. Gibbs; Laurent Omnès; Peter N. Horton; Michael B. Hursthouse; Duncan W. Bruce","Orthometallated palladium(<small>II</small>) imine complexes as candidate materials for the biaxial nematic phase. Crystal and molecular structure of three palladium imine complexes","Journal of Materials Chemistry","2006","16","44","4316","","10.1039/b608823f","","","0.71073","MoKα","","0.1037","0.0464","","","0.0942","0.1144","","","","","","0.999","","","","has coordinates,has disorder","180366","2020-10-21","18:00:00",""
"7203564","7.2721","0.001","7.2721","0.001","23.632","0.005","90","","90","","90","","1249.7","0.4","150","0.2","150","0.2","","","","","","","","6","I 41/a m d :2","-I 4bd 2","141","Tetramethylammonium Uranium oxide fluoride","Tetramethylammonium Uranium oxide fluoride","","- C4 H12 F5 N O4 U2 -","- C4 H12 F5 N O4 U2 -","- C16 H48 F20 N4 O16 U8 -","4","0.125","","Ok, Kang Min; Doran, Michael B.; O'Hare, Dermot","[N(CH3)4][(UO2)2F5]: A new organically templated open-framework uranium oxide fluoride (MUF-2)","Journal of Materials Chemistry","2006","16","33","3366","","10.1039/b609525a","","","0.71073","MoKα","","0.0316","0.0209","","","0.0436","0.0465","","","","","","1.007","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203565","7.767","0.0016","16.964","0.003","11.255","0.002","90","","105.98","0.03","90","","1425.6","0.5","150","0.2","150","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Tetramethylammonium uranium oxide nitrate","Tetramethylammonium uranium oxide nitrate","","- C4 H12 N4 O11 U -","- C4 H12 N4 O11 U -","- C16 H48 N16 O44 U4 -","4","1","","Ok, Kang Min; Doran, Michael B.; O'Hare, Dermot","[N(CH3)4][(UO2)2F5]: A new organically templated open-framework uranium oxide fluoride (MUF-2)","Journal of Materials Chemistry","2006","16","33","3366","","10.1039/b609525a","","","0.71073","MoKα","","0.0502","0.0296","","","0.0585","0.0655","","","","","","0.89","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203580","12.627","0.004","19.833","0.006","11.46","0.004","90","","96.049","0.004","90","","2854","1.6","143.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","3,5-bis(1-oxyl-3-oxide-4,4,5,5-tetramethyl-2-imidazolin-2-yl) -1-methyl-pyridinium trifluoromethanesulfonate","3,5-bis(1-oxyl-3-oxide-4,4,5,5-tetramethyl-2-imidazolin-2-yl) -1-methyl-pyridinium trifluoromethanesulfonate","","- C21 H30 F3 N5 O7 S -","- C21 H30 F3 N5 O7 S -","- C84 H120 F12 N20 O28 S4 -","4","1","","Hayakawa, Kenichi; Shiomi, Daisuke; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji","Pyridine-substituted nitronyl nitroxide biradicals: a triplet (S = 1) ground state lasting out N-methylation","Journal of Materials Chemistry","2006","16","42","4146","","10.1039/b609760j","","","0.7107","MoKα","","","0.0988","","","","0.1284","","","","","","1.236","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203581","11.275","0.004","11.242","0.004","17.688","0.006","108.566","0.003","110.869","0.003","89.344","0.003","1972.7","1.2","143.1","","","","","","","","","","","4","P -1","-P 1","2","3,5-bis(1-oxyl-3-oxide-4,4,5,5-tetramethyl-2-imidazolin-2- yl)pyridine","3,5-bis(1-oxyl-3-oxide-4,4,5,5-tetramethyl-2-imidazolin-2-yl)pyridine","","- C19 H27 N5 O4 -","- C19 H27 N5 O4 -","- C76 H108 N20 O16 -","4","2","","Hayakawa, Kenichi; Shiomi, Daisuke; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji","Pyridine-substituted nitronyl nitroxide biradicals: a triplet (S = 1) ground state lasting out N-methylation","Journal of Materials Chemistry","2006","16","42","4146","","10.1039/b609760j","","","0.7107","MoKα","","","0.0665","","","","0.0852","","","","","","1.144","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203599","8.4494","0.0017","4.7836","0.001","15.767","0.003","90","","99.491","0.003","90","","628.6","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Al F H4 O8 P2 -","- Al F H4 O8 P2 -","- Al4 F4 H16 O32 P8 -","4","1","","Parnham, Emily R.; Morris, Russell E.","Ionothermal synthesis using a hydrophobic ionic liquid as solvent in the preparation of a novel aluminophosphate chain structure","Journal of Materials Chemistry","2006","16","37","3682","","10.1039/b610774e","","","0.6999","synchrotron","","0.0706","0.055","","","0.1263","0.1376","","","","","","1.038","","","","has coordinates","180366","2020-10-21","18:00:00",""
"7203600","7.667","0.0008","13.7182","0.0013","11.7334","0.0008","90","","99.379","0.007","90","","1217.59","0.19","140","2","140","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H28 N2 O4 -","- C30 H28 N2 O4 -","- C60 H56 N4 O8 -","2","0.5","","Berner, D.; Klein, C.; Nazeeruddin, Md. K.; De Angelis, Filippo; Castellani, M.; Bugnon, Ph.; Scopelliti, R.; Zuppiroli, L.; Graetzel, M.","Efficient blue light-emitting diodes based on a classical ?push?pull? architecture molecule 4,4?-di-(2-(2,5-dimethoxyphenyl)ethenyl)-2,2?-bipyridine","Journal of Materials Chemistry","2006","16","46","4468","","10.1039/b610880f","","","0.71073","MoKα","","0.0873","0.0349","","","0.063","0.074","","","","","","0.865","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203601","20.3226","0.0018","20.3226","0.0018","7.2569","0.0013","90","","90","","120","","2595.6","0.6","293","","293","","","","","","","","","8","P 63/m c m","-P 6c 2","193","","","","- C25.2 H8.4 Cl2.4 F8 I6 N6 P1.33 Se12 -","- C25.2 H6 Cl2.4 F7.95 I6 N6 P1.34 Se12 -","- C50.4 H12 Cl4.8 F15.9 I12 N12 P2.68 Se24 -","2","0.0833333","","Imakubo, Tatsuro; Kibune, Megumi; Yoshino, Hiroko; Shirahata, Takashi; Yoza, Kenji","Hexagonal supramolecular organic conductors based on diiodo(pyrazino)tetraselenafulvalene: high yield recovery of the neutral ?-donor by a simple chemical reaction","Journal of Materials Chemistry","2006","16","42","4110","","10.1039/b611010j","","","0.71073","MoKα","","0.0404","0.0352","","","0.0999","0.1018","","","","","","1.132","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203602","20.3703","0.0017","20.3703","0.0017","7.2558","0.0012","90","","90","","120","","2607.4","0.5","293","","293","","","","","","","","","8","P 63/m c m","-P 6c 2","193","","","","- C25.2 H8.4 As1.33 Cl2.4 F8 I6 N6 Se12 -","- C25.2 H6 As1.34 Cl2.4 F7.95 I6 N6 Se12 -","- C50.4 H12 As2.68 Cl4.8 F15.9 I12 N12 Se24 -","2","0.0833333","","Imakubo, Tatsuro; Kibune, Megumi; Yoshino, Hiroko; Shirahata, Takashi; Yoza, Kenji","Hexagonal supramolecular organic conductors based on diiodo(pyrazino)tetraselenafulvalene: high yield recovery of the neutral ?-donor by a simple chemical reaction","Journal of Materials Chemistry","2006","16","42","4110","","10.1039/b611010j","","","0.71073","MoKα","","0.0464","0.0344","","","0.0891","0.117","","","","","","1.08","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203603","20.4542","0.0017","20.4542","0.0017","7.2485","0.0013","90","","90","","120","","2626.3","0.6","293","","293","","","","","","","","","8","P 63/m c m","-P 6c 2","193","","","","- C25.2 H8.4 Cl2.4 F8 I6 N6 Sb1.33 Se12 -","- C25.2 H6 Cl2.4 F7.95 I6 N6 Sb1.34 Se12 -","- C50.4 H12 Cl4.8 F15.9 I12 N12 Sb2.68 Se24 -","2","0.0833333","","Imakubo, Tatsuro; Kibune, Megumi; Yoshino, Hiroko; Shirahata, Takashi; Yoza, Kenji","Hexagonal supramolecular organic conductors based on diiodo(pyrazino)tetraselenafulvalene: high yield recovery of the neutral ?-donor by a simple chemical reaction","Journal of Materials Chemistry","2006","16","42","4110","","10.1039/b611010j","","","0.71073","MoKα","","0.059","0.0426","","","0.1004","0.1285","","","","","","1.02","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203620","16.696","0.0009","15.165","0.0008","24.3472","0.0013","90","","98.486","0.001","90","","6097.1","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","bis(kappa$2!(C$2!,N)-2-phenylpyridine)(kappa$2!(N,O)-5,7- dibromo-8-quinolinolate)iridium(iii) diethylether solvate","bis(κ^2^(C^2^,N)-2-phenylpyridine)(κ^2^(N,O)-5,7-dibromo-8- quinolinolate)iridium(III) diethylether solvate","","- C35 H30 Br2 Ir N3 O2 -","- C34.144 H27.86 Br2 Ir N3 O1.786 -","- C273.152 H222.88 Br16 Ir8 N24 O14.288 -","8","2","","Kappaun, Stefan; Eder, Sabrina; Sax, Stefan; Saf, Robert; Mereiter, Kurt; List, Emil J. W.; Slugovc, Christian","WPLEDs prepared from main-chain fluorene?iridium(iii) polymers","Journal of Materials Chemistry","2006","16","45","4389","","10.1039/b611738d","","","0.71073","MoKα","","0.054","0.0359","","","0.0776","0.0857","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203621","16.8813","0.001","9.6871","0.0006","20.1273","0.0011","90","","105.117","0.001","90","","3177.5","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","bis(kappa$2!(C$2!,N)-2-phenylpyridine)(kappa$2!(N,O)-5,7- diphenyl-8-quinolinolate)iridium(iii)","bis(κ^2^(C^2^,N)-2-phenylpyridine)(κ^2^(N,O)-5,7-diphenyl-8- quinolinolate)iridium(III)","","- C43 H30 Ir N3 O -","- C43 H30 Ir N3 O -","- C172 H120 Ir4 N12 O4 -","4","1","","Kappaun, Stefan; Eder, Sabrina; Sax, Stefan; Saf, Robert; Mereiter, Kurt; List, Emil J. W.; Slugovc, Christian","WPLEDs prepared from main-chain fluorene?iridium(iii) polymers","Journal of Materials Chemistry","2006","16","45","4389","","10.1039/b611738d","","","0.71073","MoKα","","0.0297","0.0223","","","0.0485","0.0514","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203674","11.923","0.002","12.551","0.002","25.711","0.005","90","","90","","90","","3847.5","1.2","175","2","175","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H62 Al3 F O9 S -","- C26 H62 Al3 F O9 S -","- C104 H248 Al12 F4 O36 S4 -","4","1","","Stephan K. Ruediger; Udo Groß; Michael Feist; Hillary A. Prescott; S. Chandra Shekar; Sergey I. Troyanov; Erhard Kemnitz","Non-aqueous synthesis of high surface area aluminium fluoride-a mechanistic investigation","Journal of Materials Chemistry","2005","15","5","588","","10.1039/b411457d","","","0.71073","MoKα","","0.0539","0.0365","","","0.0774","0.0815","","","","","","0.795","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203675","7.127","0.001","19.098","0.004","12.535","0.003","87.03","0.03","71.53","0.03","87.7","0.03","1615.6","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","tetra(bis(ethylenedioxo)tetrathiafulvalene) tetracyano-nickel acetonitrile solvate","","","- C26 H22 N4 Ni0.5 O8 S8 -","- C26 H16 N4 Ni0.5 O8 S8 -","- C52 H32 N8 Ni O16 S16 -","2","1","","Dubrovskii, Alexander D.; Spitsina, Nataliya G.; Buravov, Lev I.; Shilov, Gennadii V.; Dyachenko, Oleg A.; Yagubskii, Eduard B.; Laukhin, Vladimir N.; Canadell, Enric","New molecular metals based on BEDO radical cation salts with the square planar Ni(CN)42? anion","Journal of Materials Chemistry","2005","","","1248","1254","10.1039/b412580k","","","1.54178","CuKα","","0.1958","0.0748","","","0.1832","0.2091","","","","","","0.842","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203676","17.542","0.004","10.415","0.002","10.928","0.002","71.94","0.03","84.4","0.03","88.88","0.03","1889","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","penta(bis(ethylenedioxo)tetrathiafulvalene) tetracyano-nickel ethylene glycol solvate","","","- C30 H29 N2 Ni0.5 O13 S10 -","- C30 H20 N2 Ni0.5 O13 S10 -","- C60 H40 N4 Ni O26 S20 -","2","1","","Dubrovskii, Alexander D.; Spitsina, Nataliya G.; Buravov, Lev I.; Shilov, Gennadii V.; Dyachenko, Oleg A.; Yagubskii, Eduard B.; Laukhin, Vladimir N.; Canadell, Enric","New molecular metals based on BEDO radical cation salts with the square planar Ni(CN)42? anion","Journal of Materials Chemistry","2005","","","1248","1254","10.1039/b412580k","","","1.54178","CuKα","","0.127","0.0674","","","0.1864","0.2099","","","","","","0.907","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203677","12.7434","0.0009","15.6535","0.0011","17.7496","0.0013","90.56","0.01","95.93","0.01","107.64","0.01","3353","0.5","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","2,7-Bis{4-[2-(4-dodecyloxyphenyl)-1,3,4-oxadiazol-5-yl]phenyl}- 9,9-dihexylfluorene","","- C77 H98 N4 O4 -","- C77 H98 N4 O4 -","- C154 H196 N8 O8 -","2","1","","Oyston, Stephen; Wang, Changsheng; Hughes, Gregory; Batsanov, Andrei S.; Perepichka, Igor F.; Bryce, Martin R.; Ahn, Jin H.; Pearson, Christopher; Petty, Michael C.","New 2,5-diaryl-1,3,4-oxadiazole?fluorene hybrids as electron transporting materials for blended-layer organic light emitting diodes","Journal of Materials Chemistry","2005","15","1","194","","10.1039/b413066a","","","0.71073","MoKα","","0.1057","0.0573","","","0.1179","0.1402","","","","","","1.008","","","","has coordinates,has disorder","180367","2020-10-21","18:00:00",""
"7203678","29.331","0.002","12.128","0.001","41.706","0.003","90","","108.896","0.002","90","","14036.4","1.8","140","1","140","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Compound 1","","","- C80 H112 Cl In N8 -","- C80 H77 Cl In N8 -","- C640 H616 Cl8 In8 N64 -","8","1","","Aurélien Auger; Paul M. Burnham; Isabelle Chambrier; Michael J. Cook; David L. Hughes","X-Ray crystallographic studies of three substituted indium(iii) phthalocyanines: effect of ring substitution and the axial ligand on molecular geometry and packing","Journal of Materials Chemistry","2005","15","1","168","","10.1039/b413189b","","","0.71073","Mo-Kα","","0.064","0.0577","","","0.1393","0.1432","","","","","","1.164","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203679","12.873","0.003","17.91","0.004","17.642","0.004","102.92","0.03","93.73","0.03","90.5","0.03","3955","1.6","293","1","293","1","","","","","","","","5","P -1","-P 1","2","Compound 2","","","- C86 H116 F In N8 -","- C86 H90 F In N8 -","- C172 H180 F2 In2 N16 -","2","1","","Aurélien Auger; Paul M. Burnham; Isabelle Chambrier; Michael J. Cook; David L. Hughes","X-Ray crystallographic studies of three substituted indium(iii) phthalocyanines: effect of ring substitution and the axial ligand on molecular geometry and packing","Journal of Materials Chemistry","2005","15","1","168","","10.1039/b413189b","","","0.71073","Mo-Kα","","0.1582","0.0645","","","0.1279","0.1596","","","","","","0.935","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203680","12.694","0.003","17.033","0.003","17.996","0.004","108.54","0.03","103.32","0.03","92.96","0.03","3556.8","1.6","140","1","140","1","","","","","","","","7","P -1","-P 1","2","Compound 3","","","- C76 H103 Br Cl In N8 O2 -","- C76 H103 Br Cl In N8 O2 -","- C152 H206 Br2 Cl2 In2 N16 O4 -","2","1","","Aurélien Auger; Paul M. Burnham; Isabelle Chambrier; Michael J. Cook; David L. Hughes","X-Ray crystallographic studies of three substituted indium(iii) phthalocyanines: effect of ring substitution and the axial ligand on molecular geometry and packing","Journal of Materials Chemistry","2005","15","1","168","","10.1039/b413189b","","","0.71073","Mo-Kα","","0.1258","0.0682","","","0.1707","0.1885","","","","","","0.936","","","","has coordinates,has disorder","180367","2020-10-21","18:00:00",""
"7203681","10.0229","0.0002","5.958","0.0001","34.9009","0.0006","90","","90","","90","","2084.16","0.07","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C8 H9 Cd O6 P -","- C8 Cd O6 P -","- C64 Cd8 O48 P8 -","8","2","","Stock, Norbert; Bein, Thomas","High-throughput investigation of metal carboxyarylphosphonate hybrid compounds","Journal of Materials Chemistry","2005","15","13","1384","","10.1039/b413318h","","","0.71073","MoKα","","0.0728","0.0476","","","0.1371","0.1519","","","","","","1.116","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203682","4.5914","0.0006","5.981","0.0008","17.811","0.003","81.513","0.016","86.272","0.016","82.251","0.015","478.83","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Copper di(4-methylene-hydrogenphosphono-benzoic acid)-di-hydrate","","","- C16 H20 Cu O12 P2 -","- C16 H20 Cu O12 P2 -","- C16 H20 Cu O12 P2 -","1","0.5","","Stock, Norbert; Bein, Thomas","High-throughput investigation of metal carboxyarylphosphonate hybrid compounds","Journal of Materials Chemistry","2005","15","13","1384","","10.1039/b413318h","","","0.71073","MoKα","","0.0904","0.0395","","","0.0658","0.075","","","","","","0.809","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203683","4.6198","0.0001","5.9379","0.0002","18.0676","0.0002","83.119","0.002","88.307","0.002","84.461","0.002","489.68","0.02","293","2","200","","","","","","","","","5","P -1","-P 1","2","","Manganese di(4-methylene-hydrogenphosphono-benzoic acid)-di-hydrate","","- C16 H20 Mn O12 P2 -","- C16 H20 Mn O12 P2 -","- C16 H20 Mn O12 P2 -","1","0.5","","Stock, Norbert; Bein, Thomas","High-throughput investigation of metal carboxyarylphosphonate hybrid compounds","Journal of Materials Chemistry","2005","15","13","1384","","10.1039/b413318h","","","0.71073","MoKα","","0.0519","0.0347","","","0.0783","0.0843","","","","","","1.057","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203684","9.8261","0.0001","5.8393","0.0001","35.252","0.0004","90","","90","","90","","2022.67","0.05","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C8 H9 Mn O6 P -","- C8 Mn O6 P -","- C64 Mn8 O48 P8 -","8","2","","Stock, Norbert; Bein, Thomas","High-throughput investigation of metal carboxyarylphosphonate hybrid compounds","Journal of Materials Chemistry","2005","15","13","1384","","10.1039/b413318h","","","0.71073","MoKα","","0.1063","0.0736","","","0.205","0.2288","","","","","","1.107","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203685","7.1061","0.0008","5.9558","0.0007","34.129","0.004","90","","90","","90","","1444.4","0.3","160","2","160","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","1,2-bis(4'-carbomethoxyphenyl)ethyne","1,2-bis(4'-carbomethoxyphenyl)ethyne","","- C18 H14 O4 -","- C18 H14 O4 -","- C72 H56 O16 -","4","0.5","","Tolulope M. Fasina; Jonathan C. Collings; Jacqueline M. Burke; Andrei S. Batsanov; Richard M. Ward; David Albesa-Jové; Laurent Porrès; Andrew Beeby; Judith A. K. Howard; Andrew J. Scott; William Clegg; Stephen W. Watt; Christopher Viney; Todd B. Marder","Synthesis, optical properties, crystal structures and phase behaviour of symmetric, conjugated ethynylarene-based rigid rods with terminal carboxylate groups","Journal of Materials Chemistry","2005","15","6","690","","10.1039/b413514h","","","0.71073","MoKα","","0.0512","0.0405","","","0.1065","0.112","","","","","","1.085","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203686","7.0249","0.0005","10.4613","0.0008","11.7016","0.0008","75.204","0.003","72.585","0.003","75.457","0.003","778.97","0.1","120","2","120","2","","","","","","","","3","P -1","-P 1","2","1,4-Bis(4-carbomethoxyphenyl)butadiyne","1,4-Bis(4-carbomethoxyphenyl)butadiyne","","- C20 H14 O4 -","- C20 H14 O4 -","- C40 H28 O8 -","2","1","","Tolulope M. Fasina; Jonathan C. Collings; Jacqueline M. Burke; Andrei S. Batsanov; Richard M. Ward; David Albesa-Jové; Laurent Porrès; Andrew Beeby; Judith A. K. Howard; Andrew J. Scott; William Clegg; Stephen W. Watt; Christopher Viney; Todd B. Marder","Synthesis, optical properties, crystal structures and phase behaviour of symmetric, conjugated ethynylarene-based rigid rods with terminal carboxylate groups","Journal of Materials Chemistry","2005","15","6","690","","10.1039/b413514h","","","0.71073","MoKα","","0.0718","0.0551","","","0.1307","0.1406","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203687","7.225","0.001","11.66","0.001","15.381","0.001","77.343","0.001","83.037","0.001","72.026","0.001","1200.6","0.2","110","2","110","2","","","","","","","","3","P -1","-P 1","2","9,10-bis(4'-carbomethoxyphenylethynyl)anthracene","9,10-bis(4'-carbomethoxyphenylethynyl)anthracene","","- C34 H22 O4 -","- C34 H22 O4 -","- C68 H44 O8 -","2","1","","Tolulope M. Fasina; Jonathan C. Collings; Jacqueline M. Burke; Andrei S. Batsanov; Richard M. Ward; David Albesa-Jové; Laurent Porrès; Andrew Beeby; Judith A. K. Howard; Andrew J. Scott; William Clegg; Stephen W. Watt; Christopher Viney; Todd B. Marder","Synthesis, optical properties, crystal structures and phase behaviour of symmetric, conjugated ethynylarene-based rigid rods with terminal carboxylate groups","Journal of Materials Chemistry","2005","15","6","690","","10.1039/b413514h","","","0.71073","MoKα","","0.0592","0.04","","","0.1075","0.12","","","","","","1.019","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203688","11.254","0.0002","11.9432","0.0002","23.8124","0.0007","90","","90","","90","","3200.6","0.12","173","","173","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H23 N2 O3 -","- C16 H23 N2 O3 -","- C128 H184 N16 O24 -","8","1","","Christophe Stroh; Raymond Ziessel; Gabriele Raudaschl-Sieber; Frank H. Köhler; Philippe Turek","Intramolecular exchange interactions in non-aromatic bis-nitronyl-nitroxides","Journal of Materials Chemistry","2005","15","8","850","","10.1039/b414284e","","","0.71073","Mo-Kα","","0.089","0.037","","0.51","","0.058","","","8.845","","","1.041","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203689","7.0087","0.0004","16.27","0.001","10.3874","0.0005","90","","99.244","0.004","90","","1169.11","0.11","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 N4 O4 -","- C22 H34 N4 O4 -","- C44 H68 N8 O8 -","2","0.5","","Christophe Stroh; Raymond Ziessel; Gabriele Raudaschl-Sieber; Frank H. Köhler; Philippe Turek","Intramolecular exchange interactions in non-aromatic bis-nitronyl-nitroxides","Journal of Materials Chemistry","2005","15","8","850","","10.1039/b414284e","","","0.71073","Mo-Kα","","0.087","0.048","","0.081","","0.076","","","1.597","","","1.556","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203690","10.319","0.0006","9.7704","0.0008","12.362","0.0008","90","","113.394","0.006","90","","1143.89","0.15","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H32 N4 O4 -","- C22 H24 N4 O4 -","- C44 H48 N8 O8 -","2","0.5","","Christophe Stroh; Raymond Ziessel; Gabriele Raudaschl-Sieber; Frank H. Köhler; Philippe Turek","Intramolecular exchange interactions in non-aromatic bis-nitronyl-nitroxides","Journal of Materials Chemistry","2005","15","8","850","","10.1039/b414284e","","","0.71073","Mo-Kα","","0.112","0.056","","0.106","","0.072","","","1.573","","","1.114","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203691","12.0367","0.0011","20.9059","0.0018","8.6999","0.0008","90","","90","","90","","2189.2","0.3","273","2","273","2","","","","","","","","4","P n a 21","P 2c -2n","33","2,4,6-tris(4-fluorobenzylamino)-1,3,5-triazine","2,4,6-tris(4-fluorobenzylamino)-1,3,5-triazine","","- C24 H21 F3 N6 -","- C24 H21 F3 N6 -","- C96 H84 F12 N24 -","4","1","","Srinivas, K.; Sitha, Sanyasi; Rao, V. Jayathirtha; Bhanuprakash, K.; Ravikumar, K.; Anthony, S. Philip; Radhakrishnan, T. P.","First hyperpolarizability of some nonconjugated donor?acceptor 3D molecules: noncentrosymmetric crystal through conformational flexibility","Journal of Materials Chemistry","2005","15","9","965","","10.1039/b414311f","","","0.71073","MoKα","","0.0741","0.0456","","","0.0962","0.1085","","","","","","1.113","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203692","11.2451","0.0005","11.7178","0.0005","14.2394","0.0006","106.876","0.001","91.234","0.001","100.583","0.001","1759.35","0.13","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C47 H35 Ir N2 O2 -","- C47 H35 Ir N2 O2 -","- C94 H70 Ir2 N4 O4 -","2","1","","Wu, Fang-Iy; Su, Huei-Jen; Shu, Ching-Fong; Luo, Liyang; Diau, Wei-Guang; Cheng, Chien-Hong; Duan, Jiun-Pey; Lee, Gene-Hsiang","Tuning the emission and morphology of cyclometalated iridium complexes and their applications to organic light-emitting diodes","Journal of Materials Chemistry","2005","15","10","1035","","10.1039/b415754k","","","0.71073","MoKα","","0.0405","0.0347","","","0.0708","0.0787","","","","","","1.03","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203697","8.8461","0.0016","11.626","0.002","14.915","0.003","90","","91.171","0.003","90","","1533.6","0.5","100","2","100","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C24 H56 As2 In2 -","- C24 H56 As2 In2 -","- C48 H112 As4 In4 -","2","0.5","","Malik, Mohammad Azad; O'Brien, Paul; Helliwell, M.","A new synthesis of InAs quantum dots from [tBu2AsInEt2]2","Journal of Materials Chemistry","2005","15","14","1463","","10.1039/b416944a","","","0.71073","MoKα","","0.0518","0.0449","","","0.1022","0.1057","","","","","","1.112","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203707","10.2341","0.0004","18.9036","0.0008","15.6521","0.0006","90","","105.011","0.001","90","","2924.7","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H46 Hf N2 O6 -","- C24 H46 Hf N2 O6 -","- C96 H184 Hf4 N8 O24 -","4","1","","Loo, Yim Fun; O'Kane, Ruairi; Jones, Anthony C.; Aspinall, Helen C.; Potter, Richard J.; Chalker, Paul R.; Bickley, Jamie F.; Taylor, Stephen; Smith, Lesley M.","Deposition of HfO2 and ZrO2 films by liquid injection MOCVD using new monomeric alkoxide precursors","Journal of Materials Chemistry","2005","15","19","1896","","10.1039/b417389a","","","0.71073","MoKα","","0.0341","0.0277","","","0.0693","0.0719","","","","","","1.062","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203708","10.2627","0.0009","18.9374","0.0017","15.6465","0.0014","90","","104.772","0.002","90","","2940.4","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H46 N2 O6 Zr -","- C24 H46 N2 O6 Zr -","- C96 H184 N8 O24 Zr4 -","4","1","","Loo, Yim Fun; O'Kane, Ruairi; Jones, Anthony C.; Aspinall, Helen C.; Potter, Richard J.; Chalker, Paul R.; Bickley, Jamie F.; Taylor, Stephen; Smith, Lesley M.","Deposition of HfO2 and ZrO2 films by liquid injection MOCVD using new monomeric alkoxide precursors","Journal of Materials Chemistry","2005","15","19","1896","","10.1039/b417389a","","","0.71073","MoKα","","0.0355","0.0309","","","0.0777","0.0799","","","","","","1.018","","","","has coordinates,has disorder","180368","2020-10-21","18:00:00",""
"7203725","8.741","0.0004","11.9042","0.0006","17.1842","0.0006","95.305","0.004","92.646","0.003","95.136","0.004","1770.61","0.14","295","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C47 H37 Cl5 N2 O Os S32 -","- C47 H37 Cl5 N2 O Os S32 -","- C47 H37 Cl5 N2 O Os S32 -","1","0.5","","Simonov, Sergey V.; Shevyakova, Irina Yu.; Zorina, Leokadiya V.; Khasanov, Salavat S.; Buravov, Lev I.; Emel'yanov, Vyacheslav A.; Canadell, Enric; Shibaeva, Rimma P.; Yagubskii, Eduard B.","Variety of molecular conducting layers in the family of radical cation salts based on BEDT-TTF with the metal mononitrosyl complex [OsNOCl5]2‒","Journal of Materials Chemistry","2005","15","25","2476","","10.1039/b419134j","","x-ray","0.71073","Mokα","","0.0474","0.0363","","","0.0793","0.0843","","","","","","1.015","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203726","8.7249","0.0003","10.338","0.0005","11.0927","0.0006","110.41","0.004","98.41","0.004","103.834","0.004","881.06","0.08","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H16 Cl5 N O Os S8 -","- C20 H16 Cl5 N O Os S16 -","- C20 H16 Cl5 N O Os S16 -","1","0.5","","Simonov, Sergey V.; Shevyakova, Irina Yu.; Zorina, Leokadiya V.; Khasanov, Salavat S.; Buravov, Lev I.; Emel'yanov, Vyacheslav A.; Canadell, Enric; Shibaeva, Rimma P.; Yagubskii, Eduard B.","Variety of molecular conducting layers in the family of radical cation salts based on BEDT-TTF with the metal mononitrosyl complex [OsNOCl5]2‒","Journal of Materials Chemistry","2005","15","25","2476","","10.1039/b419134j","","x-ray","0.71073","Mokα","","0.0258","0.0247","","","0.063","0.0633","","","","","","1.075","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203727","15.034","0.003","6.728","0.002","35.211","0.006","90","","92.98","0.01","90","","3556.7","1.4","293","2","295","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C44 H35.33 Cl6.66 N2 O2.67 Os1.33 S32 -","- C40 H32 Cl7.016 N1.404 O1.404 Os1.404 S32 -","- C80 H64 Cl14.032 N2.808 O2.808 Os2.808 S64 -","2","0.25","","Simonov, Sergey V.; Shevyakova, Irina Yu.; Zorina, Leokadiya V.; Khasanov, Salavat S.; Buravov, Lev I.; Emel'yanov, Vyacheslav A.; Canadell, Enric; Shibaeva, Rimma P.; Yagubskii, Eduard B.","Variety of molecular conducting layers in the family of radical cation salts based on BEDT-TTF with the metal mononitrosyl complex [OsNOCl5]2‒","Journal of Materials Chemistry","2005","15","25","2476","","10.1039/b419134j","","x-ray","0.71073","Mokα","","0.0836","0.0493","","","0.1389","0.1563","","","","","","1.097","","","","has coordinates,has disorder","180368","2020-10-21","18:00:00",""
"7203728","9.6275","0.0006","11.1599","0.0006","18.064","0.001","101.478","0.005","91.926","0.006","110.894","0.005","1765.31","0.19","293","2","292","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H37 Cl5 N2 O3 Os S32 -","- C45.976 H36.98 Cl5 N1.996 O2.992 Os S32 -","- C45.976 H36.98 Cl5 N1.996 O2.992 Os S32 -","1","0.5","","Simonov, Sergey V.; Shevyakova, Irina Yu.; Zorina, Leokadiya V.; Khasanov, Salavat S.; Buravov, Lev I.; Emel'yanov, Vyacheslav A.; Canadell, Enric; Shibaeva, Rimma P.; Yagubskii, Eduard B.","Variety of molecular conducting layers in the family of radical cation salts based on BEDT-TTF with the metal mononitrosyl complex [OsNOCl5]2‒","Journal of Materials Chemistry","2005","15","25","2476","","10.1039/b419134j","","x-ray","0.71073","Mokα","","0.039","0.0329","","","0.0793","0.0941","","","","","","1.085","","","","has coordinates,has disorder","180368","2020-10-21","18:00:00",""
"7203729","10.2875","0.0003","20.0546","0.0015","35.513","0.002","90","","93.238","0.005","90","","7315.1","0.7","292","2","292","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H40 Br Fe O13 S32 -","- C52 H37 Br Fe O13 S32 -","- C208 H148 Br4 Fe4 O52 S128 -","4","0.5","","Eugenio Coronado; Simona Curreli; Carlos Giménez-Saiz; Carlos J. Gómez-García","A novel paramagnetic molecular superconductor formed by bis(ethylenedithio)tetrathiafulvalene, tris(oxalato)ferrate(iii) anions and bromobenzene as guest molecule: ET4[(H3O)Fe(C2O4)3]�C6H5Br","Journal of Materials Chemistry","2005","15","14","1429","","10.1039/b500107m","","","0.71073","MoKα","","0.1086","0.0487","","","0.1089","0.1333","","","","","","1.06","","","","has coordinates,has disorder","180368","2020-10-21","18:00:00",""
"7203738","5.317","0.001","8.265","0.002","12.265","0.003","99.7","0.01","91.54","0.01","89.18","0.01","531.1","0.2","173.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C26 H34 N4 -","- C26 H34 N4 -","- C26 H34 N4 -","1","0.5","","Kubo, Kanji; Mori, Akira","PET fluoroionophores for Zn2+ and Cu2+: complexation and fluorescence behavior of anthracene derivatives having diethylamine, N-methylpiperazine and N,N-bis(2-picolyl)amine units","Journal of Materials Chemistry","2005","15","27-28","2902","","10.1039/b501361e","","","1.5419","CuKα","","","0.051","","","","0.154","","","","","","1.082","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203739","10.573","0.003","10.677","0.003","15.007","0.004","90","","102.55","0.01","90","","1653.6","0.8","173.1","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C40 H36 N6 -","- C40 H36 N6 -","- C80 H72 N12 -","2","0.5","","Kubo, Kanji; Mori, Akira","PET fluoroionophores for Zn2+ and Cu2+: complexation and fluorescence behavior of anthracene derivatives having diethylamine, N-methylpiperazine and N,N-bis(2-picolyl)amine units","Journal of Materials Chemistry","2005","15","27-28","2902","","10.1039/b501361e","","","1.5419","CuKα","","","0.036","","","","0.096","","","","","","1.047","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203740","17.53","0.004","12.1","0.003","13.194","0.003","90","","115.43","0.01","90","","2527.5","1","173.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H34 Cl4 N2 Zn -","- C24 H34 Cl4 N2 Zn -","- C96 H136 Cl16 N8 Zn4 -","4","0.5","","Kubo, Kanji; Mori, Akira","PET fluoroionophores for Zn2+ and Cu2+: complexation and fluorescence behavior of anthracene derivatives having diethylamine, N-methylpiperazine and N,N-bis(2-picolyl)amine units","Journal of Materials Chemistry","2005","15","27-28","2902","","10.1039/b501361e","","","1.5419","CuKα","","","0.035","","","","0.095","","","","","","1.083","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203741","10.283","0.002","14.73","0.003","12.818","0.002","90","","101.67","0.01","90","","1901.4","0.6","173.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H36 Cl4 N6 Zn2 -","- C40 H36 Cl4 N6 Zn2 -","- C80 H72 Cl8 N12 Zn4 -","2","0.5","","Kubo, Kanji; Mori, Akira","PET fluoroionophores for Zn2+ and Cu2+: complexation and fluorescence behavior of anthracene derivatives having diethylamine, N-methylpiperazine and N,N-bis(2-picolyl)amine units","Journal of Materials Chemistry","2005","15","27-28","2902","","10.1039/b501361e","","","1.5419","CuKα","","","0.044","","","","0.113","","","","","","1.087","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203747","19.056","0.002","7.536","0.001","13.524","0.001","90","","90","","90","","1942.1","0.4","293","2","293","2","","","","","","","synthesis as described","4","P b c n","-P 2n 2ab","60","","","","- C11 H9 O S -","- C11 H9 O S -","- C88 H72 O8 S8 -","8","1","","Leriche, Philippe; Frère, Pierre; Roncali, Jean","Structure‒reactivity relationships in bithiophenic precursors based on the 3-phenoxythiophene building block","Journal of Materials Chemistry","2005","15","34","3473","","10.1039/b502164b","","x-ray","0.71073","MoKα","","0.0776","0.0461","","","0.1163","0.129","","","","","","0.971","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203748","11.9649","0.0009","16.5185","0.0012","20.8305","0.0016","90","","90.886","0.001","90","","4116.5","0.5","158","2","158","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H160 N8 O52 Si8 -","- C38 H106 N8 O52 Si8 -","- C76 H212 N16 O104 Si16 -","2","0.5","","Asuncion, M. Z.; Hasegawa, I.; Kampf, J. W.; Laine, R. M.","The selective dissolution of rice hull ash to form [OSiO1.5]8[R4N]8(R = Me, CH2CH2OH) octasilicates. Basic nanobuilding blocks and possible models of intermediates formed during biosilicification processes","Journal of Materials Chemistry","2005","15","21","2114","","10.1039/b502178b","","","0.71073","MoKα","","0.0973","0.0676","","","0.2122","0.2294","","","","","","1.095","","","","has coordinates,has disorder","180368","2020-10-21","18:00:00",""
"7203762","13.9176","0.0001","13.9176","0.0001","13.9176","0.0001","90","","90","","90","","2695.83","0.03","293","2","293","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C H4 Cl In0.33 N2 O -","- C H4 Cl In0.333333 N2 O -","- C24 H96 Cl24 In8 N48 O24 -","24","1","","Sardar, Kripasindhu; Dan, Meenakshi; Schwenzer, Birgit; Rao, C. N. R.","A simple single-source precursor route to the nanostructures of AlN, GaN and InN","Journal of Materials Chemistry","2005","15","22","2175","","10.1039/b502887f","","","0.71073","MoKα","","0.0245","0.0227","","0.0574","0.0568","","","","1.255","1.288","1.288","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203763","16.495","0.007","16.495","0.007","14.697","0.008","90","","90","","120","","3463","3","293","2","293","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C1.5 H6 Cl0.75 Ga0.25 N3 O1.5 -","- C1.5 H6 Cl0.75 Ga0.25 N3 O1.5 -","- C36 H144 Cl18 Ga6 N72 O36 -","24","2","","Sardar, Kripasindhu; Dan, Meenakshi; Schwenzer, Birgit; Rao, C. N. R.","A simple single-source precursor route to the nanostructures of AlN, GaN and InN","Journal of Materials Chemistry","2005","15","22","2175","","10.1039/b502887f","","","0.71073","MoKα","","0.1613","0.0613","","0.1555","0.1212","","","","1.017","1.198","1.198","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203764","5.254","0.003","14.407","0.004","16.82","0.003","112.813","0.004","90.92","0.04","99.08","0.07","1154.7","0.8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H64 N2 O6 -","- C54 H64 N2 O6 -","- C54 H64 N2 O6 -","1","0.5","","Dautel, Olivier J.; Wantz, Guillaume; Flot, David; Lere-Porte, Jean-Pierre; Moreau, Joël J. E.; Parneix, Jean-Paul; Serein-Spirau, Françoise; Vignau, Laurence","Confined photoactive substructures on a chiral scaffold: the design of an electroluminescent polyimide as material for PLED**","Journal of Materials Chemistry","2005","15","41","4446","","10.1039/b503284a","","x-ray","0.7305","","","0.0691","0.0658","","","0.1746","0.1796","","","","","","0.982","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203767","9.7347","0.0007","9.7347","","7.2531","0.0006","90","","90","","120","","595.25","0.07","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- La1.33 O4.33 Si Sr0.33 -","- La1.33333 O4.33353 Si Sr0.333333 -","- La8 O26.0012 Si6 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.11","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203768","9.77167","0.00028","9.77167","","7.21223","0.00021","90","","90","","120","","596.4","0.02","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.56 O4.33 Si -","- La1.56067 O4.33313 Si -","- La9.364 O25.9988 Si6 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.95","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203769","9.8527","0.0017","9.8527","","7.2714","0.0013","90","","90","","120","","611.31","0.15","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge0.5 La1.56 O4.33 Si0.5 -","- Ge0.5 La1.55533 O4.3334 Si0.5 -","- Ge3 La9.332 O26.0004 Si3 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.98","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203770","9.9422","0.0006","9.9422","","7.3358","0.0004","90","","90","","120","","627.98","0.05","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge La1.33 O4.33 Sr0.33 -","- Ge La1.33333 O4.3334 Sr0.333333 -","- Ge6 La8 O26.0004 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.4","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203771","9.81164","0.00032","9.81164","","7.23354","0.00024","90","","90","","120","","603.07","0.03","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.56 O4.35 Si -","- La1.56067 O4.35473 Si -","- La9.364 O26.1284 Si6 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.71","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203772","9.91268","0.00012","9.91268","","7.31937","0.0001","90","","90","","120","","622.854","0.011","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge La1.33 O4.33 Sr0.33 -","- Ge La1.33333 O4.33327 Sr0.333333 -","- Ge6 La8 O25.9996 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.75","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203773","9.8335","0.0004","9.8335","","7.25285","0.00032","90","","90","","120","","607.37","0.04","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge0.5 La1.56 O4.33 Si0.5 -","- Ge0.5 La1.55533 O4.33327 Si0.5 -","- Ge3 La9.332 O25.9996 Si3 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","2.06","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203774","9.728","0.006","9.728","","7.19","0.004","90","","90","","120","","589.3","0.5","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.55 O4.33 Si -","- La1.55467 O4.33347 Si -","- La9.328 O26.0008 Si6 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","129.07","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203775","9.71191","0.00008","9.71191","","7.23956","0.00007","90","","90","","120","","591.36","0.008","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- La1.33 O4.33 Si Sr0.33 -","- La1.33333 O4.33353 Si Sr0.333333 -","- La8 O26.0012 Si6 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.7","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203786","16.5249","0.0019","5.6048","0.0006","17.472","0.002","90","","99.608","0.002","90","","1595.5","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-[4,5-Bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]-1-(4-nitrophenyl)propyne","","- C16 H11 N O6 S2 -","- C16 H11 N O6 S2 -","- C64 H44 N4 O24 S8 -","4","1","","Nielsen, Mogens Brøndsted; Petersen, Jan Conrad; Thorup, Niels; Jessing, Mikkel; Andersson, Asbjørn Sune; Jepsen, Anne Sofie; Gisselbrecht, Jean-Paul; Boudon, Corinne; Gross, Maurice","Acetylenic dithiafulvene derived donor‒π‒acceptor dyads: synthesis, electrochemistry and non-linear optical properties","Journal of Materials Chemistry","2005","15","26","2599","","10.1039/b504124d","","","0.71073","MoKα","","0.0834","0.042","","","0.083","0.0959","","","","","","0.971","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203788","9.8105","0.0002","9.9054","0.0002","17.7854","0.0002","90","","101.771","0.001","90","","1691.99","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Cd N2 O5 -","- C18 H12 Cd N2 O5 -","- C72 H48 Cd4 N8 O20 -","4","1","","Thirumurugan, A.; Rao, C. N. R.","1,2-, 1,3- and 1,4-Benzenedicarboxylates of Cd and Zn of different dimensionalities: Process of formation of the three-dimensional structure","Journal of Materials Chemistry","2005","15","35-36","3852","","10.1039/b504666a","","","0.71073","MoKα","","0.0356","0.0257","","","0.0651","0.0689","","","","","","1.019","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203789","10.4092","0.0002","19.7245","0.0005","8.4632","0.0002","90","","90","","90","","1737.63","0.07","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H14 Cd N2 O5 -","- C18 H14 Cd N2 O5 -","- C72 H56 Cd4 N8 O20 -","4","1","","Thirumurugan, A.; Rao, C. N. R.","1,2-, 1,3- and 1,4-Benzenedicarboxylates of Cd and Zn of different dimensionalities: Process of formation of the three-dimensional structure","Journal of Materials Chemistry","2005","15","35-36","3852","","10.1039/b504666a","","","0.71073","MoKα","","0.0169","0.016","","","0.0369","0.0372","","","","","","1.083","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203790","22.1574","0.0004","10.1982","0.0002","30.7709","0.0002","90","","102.36","0.001","90","","6792","0.19","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H26 Cd2 N4 O9 -","- C40 H24 Cd2 N4 O9 -","- C320 H192 Cd16 N32 O72 -","8","1","","Thirumurugan, A.; Rao, C. N. R.","1,2-, 1,3- and 1,4-Benzenedicarboxylates of Cd and Zn of different dimensionalities: Process of formation of the three-dimensional structure","Journal of Materials Chemistry","2005","15","35-36","3852","","10.1039/b504666a","","","0.71073","MoKα","","0.0372","0.0267","","","0.0611","0.0655","","","","","","1.068","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203791","9.643","","8.9796","0.0001","21.4183","0.0003","90","","90.759","0.001","90","","1854.45","0.03","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 N2 O6 Zn -","- C20 H16 N2 O6 Zn -","- C80 H64 N8 O24 Zn4 -","4","1","","Thirumurugan, A.; Rao, C. N. R.","1,2-, 1,3- and 1,4-Benzenedicarboxylates of Cd and Zn of different dimensionalities: Process of formation of the three-dimensional structure","Journal of Materials Chemistry","2005","15","35-36","3852","","10.1039/b504666a","","","0.71073","MoKα","","0.0306","0.0261","","","0.0701","0.0722","","","","","","1.045","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203792","6.5021","0.0001","6.9509","0.0002","18.3199","0.0001","90","","90","","90","","827.98","0.03","293","2","293","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C4 H2.5 Cd0.5 O2.5 -","- C4 H2 Cd0.5 O2.5 -","- C32 H16 Cd4 O20 -","8","1","","Thirumurugan, A.; Rao, C. N. R.","1,2-, 1,3- and 1,4-Benzenedicarboxylates of Cd and Zn of different dimensionalities: Process of formation of the three-dimensional structure","Journal of Materials Chemistry","2005","15","35-36","3852","","10.1039/b504666a","","","0.71073","MoKα","","0.0253","0.0221","","","0.061","0.0626","","","","","","1.101","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203793","10.4883","0.0002","13.1483","0.0001","13.1207","0.0002","90","","106.653","0.001","90","","1733.5","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 Cd N2 O4.5 -","- C20 H12 Cd N2 O4.5 -","- C80 H48 Cd4 N8 O18 -","4","1","","Thirumurugan, A.; Rao, C. N. R.","1,2-, 1,3- and 1,4-Benzenedicarboxylates of Cd and Zn of different dimensionalities: Process of formation of the three-dimensional structure","Journal of Materials Chemistry","2005","15","35-36","3852","","10.1039/b504666a","","","0.71073","MoKα","","0.0392","0.0276","","","0.0621","0.0665","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203797","11.4009","0.0007","15.0341","0.0009","22.2413","0.0013","90","","90","","90","","3812.2","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H31 N O2 -","- C20 H31 N O2 -","- C160 H248 N8 O16 -","8","2","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.0376","0.0344","","","0.0959","0.1001","","","","","","1.114","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203798","9.2246","0.001","10.591","0.0012","10.7338","0.0011","101.767","0.002","113.837","0.002","90.137","0.002","934.84","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H31 N O2 -","- C20 H31 N O2 -","- C40 H62 N2 O4 -","2","1","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.0418","0.0383","","","0.1063","0.1104","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203799","27.352","0.002","8.2035","0.0006","19.4855","0.0014","90","","115.82","0.001","90","","3935.7","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H30 N2 O4 -","- C21 H30 N2 O4 -","- C168 H240 N16 O32 -","8","1","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.0373","0.0349","","","0.0941","0.0962","","","","","","1.059","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203800","12.5764","0.0013","12.8644","0.0013","12.9625","0.0013","90","","115.3","0.002","90","","1896","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H28 N2 O4 -","- C19 H28 N2 O4 -","- C76 H112 N8 O16 -","4","1","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.0379","0.0347","","","0.0956","0.0985","","","","","","1.037","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203801","20.7738","0.0015","10.2812","0.0007","35.61","0.003","90","","93.481","0.001","90","","7591.5","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C38 H56 N4 O8 -","- C38 H56 N4 O8 -","- C304 H448 N32 O64 -","8","1","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.0465","0.0407","","","0.1043","0.1092","","","","","","1.021","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203802","20.2474","0.0014","9.7893","0.0007","20.59","0.0014","90","","108.21","0.001","90","","3876.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H56 N4 O8 -","- C38 H56 N4 O8 -","- C152 H224 N16 O32 -","4","1","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.0456","0.0397","","","0.1053","0.1107","","","","","","1.041","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203803","5.7589","0.0008","18.08","0.003","20.055","0.003","90","","90","","90","","2088.1","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H30 N2 O4 -","- C21 H30 N2 O4 -","- C84 H120 N8 O16 -","4","1","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.1238","0.0613","","","0.0958","0.1102","","","","","","0.945","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203804","5.698","0.002","12.825","0.005","15.492","0.006","105.226","0.006","96.024","0.006","96.465","0.006","1074.7","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H30 Br N O2 -","- C21 H30 Br N O2 -","- C42 H60 Br2 N2 O4 -","2","1","","Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi","Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts","Journal of Materials Chemistry","2005","15","26","2606","","10.1039/b504969e","","","0.71073","MoKα","","0.0798","0.0496","","","0.1298","0.1425","","","","","","1.056","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203805","32.8784","0.0002","9.628","0.0004","26.7125","0.0008","90","","98.853","0.002","90","","8355.2","0.4","233","2","233","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C64 H28 Cu3 N12 S24 Se12 -","- C64 H28 Cu3 N12 S24 Se12 -","- C256 H112 Cu12 N48 S96 Se48 -","4","1","","Dias, João C.; Ribas, Xavi; Morgado, Jorge; Seiça, João; Lopes, Elsa B.; Santos, Isabel C.; Henriques, Rui T.; Almeida, Manuel; Wurst, Klaus; Foury-Leylekian, Pascale; Canadell, Enric; Vidal-Gancedo, José; Veciana, Jaume; Rovira, Concepció","Multistability in a family of DT‒TTF organic radical based compounds (DT‒TTF)4[M(L)2]3 (M = Au, Cu; L = pds, pdt, bdt)","Journal of Materials Chemistry","2005","15","31","3187","","10.1039/b505724h","","","0.71073","MoKα","","0.0764","0.0496","","","0.0888","0.0966","","","","","","1.023","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203806","32.5313","0.0002","9.4923","0.0004","26.3669","0.0007","90","","99.166","0.002","90","","8038.1","0.4","233","2","233","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C64 H28 Cu3 N12 S36 -","- C64 H28 Cu3 N12 S36 -","- C256 H112 Cu12 N48 S144 -","4","1","","Dias, João C.; Ribas, Xavi; Morgado, Jorge; Seiça, João; Lopes, Elsa B.; Santos, Isabel C.; Henriques, Rui T.; Almeida, Manuel; Wurst, Klaus; Foury-Leylekian, Pascale; Canadell, Enric; Vidal-Gancedo, José; Veciana, Jaume; Rovira, Concepció","Multistability in a family of DT‒TTF organic radical based compounds (DT‒TTF)4[M(L)2]3 (M = Au, Cu; L = pds, pdt, bdt)","Journal of Materials Chemistry","2005","15","31","3187","","10.1039/b505724h","","","0.71073","MoKα","","0.0656","0.0418","","","0.0761","0.0826","","","","","","1.023","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203807","11.8136","0.0004","10.5663","0.0003","18.5831","0.00007","90","","101.834","0.002","90","","2270.35","0.1","233","2","233","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H8 Cu N4 S10 -","- C18 H8 Cu N4 S10 -","- C72 H32 Cu4 N16 S40 -","4","1","","Dias, João C.; Ribas, Xavi; Morgado, Jorge; Seiça, João; Lopes, Elsa B.; Santos, Isabel C.; Henriques, Rui T.; Almeida, Manuel; Wurst, Klaus; Foury-Leylekian, Pascale; Canadell, Enric; Vidal-Gancedo, José; Veciana, Jaume; Rovira, Concepció","Multistability in a family of DT‒TTF organic radical based compounds (DT‒TTF)4[M(L)2]3 (M = Au, Cu; L = pds, pdt, bdt)","Journal of Materials Chemistry","2005","15","31","3187","","10.1039/b505724h","","","0.71073","MoKα","","0.0657","0.0508","","","0.1252","0.13","","","","","","1.105","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203808","4.03153","0.00004","4.03153","0.00004","9.01136","0.00013","90","","90","","90","","146.464","0.003","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- F P Sr Zn -","- F P Sr Zn -","- F2 P2 Sr2 Zn2 -","2","0.125","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","2.6334","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203809","5.7978","","5.7978","","5.7978","","90","","90","","90","","194.89","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","?","- F8.00192 Sr4 -","- F8.00192 Sr4 -","","","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","6.9955","","","","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203810","4.10077","","4.10077","","7.09933","","90","","90","","120","","103.39","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","?","- P2.00012 Sr Zn2.00012 -","- P2.00012 Sr Zn2.00012 -","","","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","6.3285","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203811","9.71816","","9.71816","","7.28267","","90","","90","","120","","595.648","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- F2.00006 O24.0002 P6.00006 Sr10.0001 -","- F2.00006 O24.0002 P6.00006 Sr10.0001 -","","","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","9.8973","","","","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203812","4.15634","0.00003","4.15634","0.00003","9.45743","0.00009","90","","90","","90","","163.379","0.002","","","293","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- Ba F P Zn -","- Ba F P Zn -","- Ba2 F2 P2 Zn2 -","2","0.125","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-rayCuKα","","","","","","","","","2.0518","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203813","4.43835","0.00005","4.43835","0.00005","9.77891","0.00014","90","","90","","90","","192.634","0.004","","","293","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- Ba F Sb Zn -","- Ba F Sb Zn -","- Ba2 F2 Sb2 Zn2 -","2","0.125","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-rayCuKα","","","","","","","","","3.1914","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203814","6.20144","","6.20144","","6.20144","","90","","90","","90","","238.494","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","?","- Ba4 F8.00192 -","- Ba4 F8.00192 -","","","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","14.8398","","","","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203815","4.33653","","4.33653","","11.10471","","90","","90","","120","","180.852","","","","","","","","","","","","","1","R -3 m :H","-R 3 2""","166","","","","- Sb -","- Sb -","- Sb6 -","6","0.166667","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","19.0505","","","","","","","","has coordinates","292204","2024-06-05","14:01:47",""
"7203816","4.17927","0.00009","4.17927","0.00009","9.504","0.0002","90","","90","","90","","166","0.006","","","293","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- Ba F Mn P -","- Ba F Mn P -","- Ba2 F2 Mn2 P2 -","2","0.125","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-rayCuKα","","","","","","","","","3.3803","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203817","6.19126","","6.19126","","6.19126","","90","","90","","90","","237.322","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","?","- Ba4 F8 -","- Ba4 F8 -","","","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","16.0453","","","","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203818","7.0447","0.0009","34.734","0.003","7.622","0.001","90","","105.98","0.003","90","","1793","0.4","296.1","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C13 H6 Cl2 Fe0.5 S7 -","- C13 H6 Cl2 Fe0.5 S7 -","- C52 H24 Cl8 Fe2 S28 -","4","1","","Hiraoka, Takashi; Kamada, Yohsuke; Matsumoto, Takuya; Fujiwara, Hideki; Sugimoto, Toyonari; Noguchi, Satoru; Ishida, Takekazu; Nakazumi, Hiroyuki; Katori, Hiroko Aruga","Metallic/semiconducting behaviors and an antiferromagnetic ordering of FeBr4‒d spins in (Benzo-TTFVS)2·MX4 (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2005","15","34","3479","","10.1039/b506725a","","","0.7107","MoKα","","","0.042","","","","0.024","","","","","","1.544","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203819","7.063","0.001","34.578","0.007","7.607","0.002","90","","106.17","0.01","90","","1784.3","0.7","296.1","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C13 H6 Cl2 Ga0.5 S7 -","- C13 H6 Cl2 Ga0.5 S7 -","- C52 H24 Cl8 Ga2 S28 -","4","1","","Hiraoka, Takashi; Kamada, Yohsuke; Matsumoto, Takuya; Fujiwara, Hideki; Sugimoto, Toyonari; Noguchi, Satoru; Ishida, Takekazu; Nakazumi, Hiroyuki; Katori, Hiroko Aruga","Metallic/semiconducting behaviors and an antiferromagnetic ordering of FeBr4‒d spins in (Benzo-TTFVS)2·MX4 (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2005","15","34","3479","","10.1039/b506725a","","","0.7107","MoKα","","","0.046","","","","0.027","","","","","","1.94","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203820","7.063","0.003","35.514","0.012","7.661","0.003","90","0.0011","105.673","0.001","90","0.0011","1850.2","1.2","298.1","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C13 H6 Br2 Fe0.5 S7 -","- C13 H6 Br2 Fe0.5 S7 -","- C52 H24 Br8 Fe2 S28 -","4","1","","Hiraoka, Takashi; Kamada, Yohsuke; Matsumoto, Takuya; Fujiwara, Hideki; Sugimoto, Toyonari; Noguchi, Satoru; Ishida, Takekazu; Nakazumi, Hiroyuki; Katori, Hiroko Aruga","Metallic/semiconducting behaviors and an antiferromagnetic ordering of FeBr4‒d spins in (Benzo-TTFVS)2·MX4 (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2005","15","34","3479","","10.1039/b506725a","","","0.7107","MoKα","","","0.05","","","","0.042","","","","","","2.293","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203821","7.073","0.002","35.602","0.007","7.661","0.002","90","0.0008","106.062","0.001","90","0.0008","1853.8","0.8","298.1","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C13 H6 Br2 Ga0.5 S7 -","- C13 H6 Br2 Ga0.5 S7 -","- C52 H24 Br8 Ga2 S28 -","4","1","","Hiraoka, Takashi; Kamada, Yohsuke; Matsumoto, Takuya; Fujiwara, Hideki; Sugimoto, Toyonari; Noguchi, Satoru; Ishida, Takekazu; Nakazumi, Hiroyuki; Katori, Hiroko Aruga","Metallic/semiconducting behaviors and an antiferromagnetic ordering of FeBr4‒d spins in (Benzo-TTFVS)2·MX4 (M = Fe, Ga; X = Cl, Br)","Journal of Materials Chemistry","2005","15","34","3479","","10.1039/b506725a","","","0.7107","MoKα","","","0.043","","","","0.035","","","","","","2.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203822","17.398","0.003","17.398","0.003","8.0808","0.0016","90","","90","","90","","2446","0.8","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C24 H20 Cu N5 O3 -","- C24 H20 Cu N5 O3 -","- C96 H80 Cu4 N20 O12 -","4","0.5","","Pârvulescu, Andrei N.; Marin, Geanina; Suwinska, Kinga; Kravtsov, Victor Ch.; Andruh, Marius; Pârvulescu, Viorica; Pârvulescu, Vasile I.","A polynuclear complex, {[Cu(bpe)2](NO3)}, with interpenetrated diamondoid networks: synthesis, properties and catalytic behavior","Journal of Materials Chemistry","2005","15","39","4234","","10.1039/b506786c","","","0.71073","MoKα","","0.0794","0.0579","","","0.1698","0.185","","","","","","1.005","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203824","9.8","0.001","12.5617","0.0013","13.7551","0.0014","78.436","0.002","70.332","0.002","68.465","0.002","1477.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H98 Al2 La2 O14 -","- C42 H98 Al2 La2 O14 -","- C42 H98 Al2 La2 O14 -","1","0.5","","Manning, Troy D.; Loo, Yim Fun; Jones, Anthony C.; Aspinall, Helen C.; Chalker, Paul R.; Bickley, Jamie F.; Smith, Lesley M.; Critchlow, Gary W.","Deposition of LaAlO3 films by liquid injection MOCVD using a new [La‒Al] single source alkoxide precursor","Journal of Materials Chemistry","2005","15","33","3384","","10.1039/b507004j","","","0.71073","MoKα","","0.0848","0.078","","","0.1734","0.1757","","","","","","1.295","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203825","35.505","0.008","35.505","0.008","15.724","0.004","90","","90","","90","","19822","8","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C62 H138 N2 O28 S2 Sn12 -","- C62 H132 N2 O28 S2 Sn12 -","- C496 H1056 N16 O224 S16 Sn96 -","8","0.5","","Ribot, François; Veautier, Delphine; Guillaudeu, Steven J.; Lalot, Thierry","Poly[{(BuSn)12O14(OH)6}(AMPS)2] and poly[methyl acrylate-co-{(BuSn)12O14(OH)6}(AMPS)2]: hybrid polymers cross-linked through electrostatic interactions","Journal of Materials Chemistry","2005","15","35-36","3973","","10.1039/b507214j","","","0.71073","MoKα","","0.0822","0.0611","","","0.1205","0.1581","","","","","","0.983","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203826","17.283","0.0012","11.7794","0.0009","19.1659","0.0014","90","","116.194","0.001","90","","3501.2","0.4","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 N6 Y -","- C30 H63 N6 Y -","- C120 H252 N24 Y4 -","4","0.5","","Päiväsaari, Jani; Dezelah, IV, Charles L.; Back, Dwayne; El-Kaderi, Hani M.; Heeg, Mary Jane; Putkonen, Matti; Niinistö, Lauri; Winter, Charles H.","Synthesis, structure and properties of volatile lanthanide complexes containing amidinate ligands: application for Er2O3 thin film growth by atomic layer deposition","Journal of Materials Chemistry","2005","15","39","4224","","10.1039/b507351k","","","0.71073","MoKα","","0.1232","0.0636","","","0.1135","0.1333","","","","","","1.03","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203827","16.973","0.0006","11.8555","0.0004","19.0849","0.0007","90","","116.065","0.001","90","","3449.8","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 La N6 -","- C30 H63 La N6 -","- C120 H252 La4 N24 -","4","0.5","","Päiväsaari, Jani; Dezelah, IV, Charles L.; Back, Dwayne; El-Kaderi, Hani M.; Heeg, Mary Jane; Putkonen, Matti; Niinistö, Lauri; Winter, Charles H.","Synthesis, structure and properties of volatile lanthanide complexes containing amidinate ligands: application for Er2O3 thin film growth by atomic layer deposition","Journal of Materials Chemistry","2005","15","39","4224","","10.1039/b507351k","","","0.71073","MoKα","","0.0469","0.0434","","","0.1189","0.1201","","","","","","1.342","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203828","17.306","0.006","11.928","0.006","19.182","0.009","90","","115.953","0.011","90","","3560","3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 Ce N6 -","- C30 H63 Ce N6 -","- C120 H252 Ce4 N24 -","4","0.5","","Päiväsaari, Jani; Dezelah, IV, Charles L.; Back, Dwayne; El-Kaderi, Hani M.; Heeg, Mary Jane; Putkonen, Matti; Niinistö, Lauri; Winter, Charles H.","Synthesis, structure and properties of volatile lanthanide complexes containing amidinate ligands: application for Er2O3 thin film growth by atomic layer deposition","Journal of Materials Chemistry","2005","15","39","4224","","10.1039/b507351k","","","0.71073","MoKα","","0.0316","0.0207","","","0.0351","0.0361","","","","","","0.836","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203829","17.2186","0.0011","11.8892","0.0007","19.2018","0.0012","90","","116.588","0.001","90","","3515.2","0.4","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 N6 Nd -","- C30 H63 N6 Nd -","- C120 H252 N24 Nd4 -","4","0.5","","Päiväsaari, Jani; Dezelah, IV, Charles L.; Back, Dwayne; El-Kaderi, Hani M.; Heeg, Mary Jane; Putkonen, Matti; Niinistö, Lauri; Winter, Charles H.","Synthesis, structure and properties of volatile lanthanide complexes containing amidinate ligands: application for Er2O3 thin film growth by atomic layer deposition","Journal of Materials Chemistry","2005","15","39","4224","","10.1039/b507351k","","","0.71073","MoKα","","0.0319","0.0236","","","0.0495","0.0504","","","","","","0.941","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203830","17.1087","0.0015","11.7908","0.0015","19.078","0.002","90","","115.944","0.001","90","","3460.7","0.6","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 Eu N6 -","- C30 H63 Eu N6 -","- C120 H252 Eu4 N24 -","4","0.5","","Päiväsaari, Jani; Dezelah, IV, Charles L.; Back, Dwayne; El-Kaderi, Hani M.; Heeg, Mary Jane; Putkonen, Matti; Niinistö, Lauri; Winter, Charles H.","Synthesis, structure and properties of volatile lanthanide complexes containing amidinate ligands: application for Er2O3 thin film growth by atomic layer deposition","Journal of Materials Chemistry","2005","15","39","4224","","10.1039/b507351k","","","0.71073","MoKα","","0.1231","0.0761","","","0.1869","0.2082","","","","","","1.009","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203831","17.268","0.003","11.7545","0.0018","19.135","0.003","90","","116.107","0.002","90","","3487.7","1","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 Er N6 -","- C30 H63 Er N6 -","- C120 H252 Er4 N24 -","4","0.5","","Päiväsaari, Jani; Dezelah, IV, Charles L.; Back, Dwayne; El-Kaderi, Hani M.; Heeg, Mary Jane; Putkonen, Matti; Niinistö, Lauri; Winter, Charles H.","Synthesis, structure and properties of volatile lanthanide complexes containing amidinate ligands: application for Er2O3 thin film growth by atomic layer deposition","Journal of Materials Chemistry","2005","15","39","4224","","10.1039/b507351k","","","0.71073","MoKα","","0.0905","0.08","","","0.242","0.2457","","","","","","1.253","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203833","6.8731","0.0004","14.3073","0.0008","22.1427","0.0012","90","","90.446","0.001","90","","2177.3","0.2","87","2","87","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Tetrazole triazole","","","- C5 H8 N10 O4 -","- C5 H8 N10 O4 -","- C40 H64 N80 O32 -","8","2","","Hong Xue; Brendan Twamley; Jean'ne M. Shreeve","Energetic salts of substituted 1,2,4-triazolium and tetrazolium 3,5-dinitro-1,2,4-triazolates","Journal of Materials Chemistry","2005","15","34","3459","","10.1039/b507996a","","","0.71073","MoKα","","0.0845","0.0555","","","0.121","0.133","","","","","","1.061","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203834","6.584","0.003","5.827","0.002","9.948","0.004","90","","97.2312","0.0016","90","","378.6","0.3","93.15","","93.15","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C2 H12 F4 N2 O2 V -","- C2 H12 F4 N2 O2 V -","- C4 H24 F8 N4 O4 V2 -","2","1","","Stephens, Nicholas F.; Buck, Manfred; Lightfoot, Philip","Polar ordering of polar octahedra in [C2N2H10][VOF4(H2O)]","Journal of Materials Chemistry","2005","15","40","4298","","10.1039/b508959j","","","0.7107","MoKα","","0.0228","0.0223","","","0.0525","0.0527","","","","","","1.041","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203835","16.095","0.002","16.647","0.002","19.39","0.002","82.61","0.01","87.7","0.01","72.94","0.01","4925.4","1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","2,7-Bis{5-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl] -thien-2-yl}-9,9-dihexylfluorene","","- C57 H62 N4 O2 S2 -","- C57 H62 N4 O2 S2 -","- C228 H248 N16 O8 S8 -","4","2","","Oyston, Stephen; Wang, Changsheng; Perepichka, Igor F.; Batsanov, Andrei S.; Bryce, Martin R.; Ahn, Jin H.; Petty, Michael C.","Enhanced electron injection and efficiency in blended-layer organic light emitting diodes with aluminium cathodes: new 2,5-diaryl-1,3,4-oxadiazole‒fluorene hybrids incorporating pyridine units","Journal of Materials Chemistry","2005","15","48","5164","","10.1039/b510003h","","","0.71073","MoKα","","0.1468","0.0483","","","0.0814","0.0993","","","","","","0.719","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203836","5.6928","","7.733","","5.4179","","90","","90","","90","","238.509","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Ca Dy Mn O6 Sn -","- Ca Dy Mn O6 Sn -","- Ca2 Dy2 Mn2 O12 Sn2 -","2","0.25","","Abakumov, Artem M.; Rossell, Marta D.; Seryakov, Sergey A.; Rozova, Marina G.; Markina, Maria M.; Van Tendeloo, Gustaaf; Antipov, Evgeny V.","Synthesis and crystal structure of novel CaRMnSnO6(R = La, Pr, Nd, Sm‒Dy) double perovskites","Journal of Materials Chemistry","2005","15","46","4899","","10.1039/b510242a","powder diffraction","","1.5406","X-ray","","0.0415","0.0334","","","0.0171","0.0175","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203837","5.6701","","7.9022","","5.5545","","90","","90","","90","","248.876","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Ca La Mn O6 Sn -","- Ca La Mn O6 Sn -","- Ca2 La2 Mn2 O12 Sn2 -","2","0.25","","Abakumov, Artem M.; Rossell, Marta D.; Seryakov, Sergey A.; Rozova, Marina G.; Markina, Maria M.; Van Tendeloo, Gustaaf; Antipov, Evgeny V.","Synthesis and crystal structure of novel CaRMnSnO6(R = La, Pr, Nd, Sm‒Dy) double perovskites","Journal of Materials Chemistry","2005","15","46","4899","","10.1039/b510242a","powder diffraction","","1.5406","X-ray","","0.0422","0.0301","","","0.0133","0.0141","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203838","5.7186","","7.8408","","5.4918","","90","","90","","90","","246.244","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Ca Mn O6 Sm Sn -","- Ca Mn O6 Sm Sn -","- Ca2 Mn2 O12 Sm2 Sn2 -","2","0.25","","Abakumov, Artem M.; Rossell, Marta D.; Seryakov, Sergey A.; Rozova, Marina G.; Markina, Maria M.; Van Tendeloo, Gustaaf; Antipov, Evgeny V.","Synthesis and crystal structure of novel CaRMnSnO6(R = La, Pr, Nd, Sm‒Dy) double perovskites","Journal of Materials Chemistry","2005","15","46","4899","","10.1039/b510242a","powder diffraction","","1.5406","X-ray","","0.0362","0.0301","","","0.0119","0.0123","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7203839","12.301","0.005","16.426","0.006","16.316","0.007","90","","99.026","0.009","90","","3256","2","155","2","155","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","DBAT 1","","","- C36 H50 N2 S -","- C36.007 H50 N2 S -","- C144.028 H200 N8 S4 -","4","1","","Clot, Olivier; Selmarten, Don; McNevin, Michael J.","Synthesis and characterization of amino-capped oligothiophene-based hole-transport materials","Journal of Materials Chemistry","2005","15","46","4934","","10.1039/b510826h","","","0.71073","MoKα","","0.1388","0.0877","","","0.2232","0.2592","","","","","","1.036","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203840","12.0888","0.0006","12.1517","0.0007","12.8142","0.0006","84.414","0.001","73.161","0.001","87.552","0.002","1792.92","0.16","156","2","156","2","","","","","","","","4","P -1","-P 1","2","DBAT 2","","","- C40 H52 N2 S2 -","- C40.005 H52 N2 S2 -","- C80.01 H104 N4 S4 -","2","1","","Clot, Olivier; Selmarten, Don; McNevin, Michael J.","Synthesis and characterization of amino-capped oligothiophene-based hole-transport materials","Journal of Materials Chemistry","2005","15","46","4934","","10.1039/b510826h","","","0.71073","MoKα","","0.2211","0.1022","","","0.2708","0.3438","","","","","","1.01","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203841","9.9758","0.0007","7.6623","0.0003","12.8922","0.0009","90","","112.418","0.005","90","","910.97","0.1","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H14 O4 S5 -","- C18 H14 O4 S5 -","- C36 H28 O8 S10 -","2","1","","Spencer, Howard J.; Skabara, Peter J.; Giles, Mark; McCulloch, Iain; Coles, Simon J.; Hursthouse, Michael B.","The first direct experimental comparison between the hugely contrasting properties of PEDOT and the all-sulfur analogue PEDTT by analogy with well-defined EDTT‒EDOT copolymers","Journal of Materials Chemistry","2005","15","45","4783","","10.1039/b511075k","","","0.71073","MoKα","","0.0294","0.0265","","","0.06","0.0615","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203842","8.1677","0.0013","8.4673","0.0015","27.674","0.005","90","","90","","90","","1913.9","0.6","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H14 O2 S7 -","- C18 H14 O2 S7 -","- C72 H56 O8 S28 -","4","1","","Spencer, Howard J.; Skabara, Peter J.; Giles, Mark; McCulloch, Iain; Coles, Simon J.; Hursthouse, Michael B.","The first direct experimental comparison between the hugely contrasting properties of PEDOT and the all-sulfur analogue PEDTT by analogy with well-defined EDTT‒EDOT copolymers","Journal of Materials Chemistry","2005","15","45","4783","","10.1039/b511075k","","","0.71073","MoKα","","0.0986","0.071","","","0.1402","0.1501","","","","","","1.124","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203843","7.281","0.003","7.93","0.003","14.519","0.005","79.806","0.008","89.564","0.009","65.582","0.007","749.3","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H20 F6 O4 Sb Se8 -","- C20 H20 F6 O4 Sb Se8 -","- C20 H20 F6 O4 Sb Se8 -","1","0.5","","Shirahata, Takashi; Kibune, Megumi; Imakubo, Tatsuro","New unsymmetrical donor dimethyl(ethylenedioxy)tetraselenafulvalene (DMEDO-TSeF): Structures and properties of its cation radical salts","Journal of Materials Chemistry","2005","15","41","4399","","10.1039/b511820d","","","0.71073","MoKα","","0.1074","0.0652","","","0.1442","0.159","","","","","","0.862","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203844","13.958","0.004","8.285","0.002","11.867","0.003","90","","109.478","0.006","90","","1293.8","0.6","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 O2 Se4 -","- C10 H10 O2 Se4 -","- C40 H40 O8 Se16 -","4","1","","Shirahata, Takashi; Kibune, Megumi; Imakubo, Tatsuro","New unsymmetrical donor dimethyl(ethylenedioxy)tetraselenafulvalene (DMEDO-TSeF): Structures and properties of its cation radical salts","Journal of Materials Chemistry","2005","15","41","4399","","10.1039/b511820d","","","0.71073","MoKα","","0.079","0.0501","","","0.1262","0.1405","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203845","7.302","0.003","7.977","0.003","13.5","0.006","73.739","0.01","79.794","0.008","79.329","0.01","735.3","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H20 F6 O4 P Se8 -","- C20 H20 F6 O4 P Se8 -","- C20 H20 F6 O4 P Se8 -","1","0.5","","Shirahata, Takashi; Kibune, Megumi; Imakubo, Tatsuro","New unsymmetrical donor dimethyl(ethylenedioxy)tetraselenafulvalene (DMEDO-TSeF): Structures and properties of its cation radical salts","Journal of Materials Chemistry","2005","15","41","4399","","10.1039/b511820d","","","0.71073","MoKα","","0.0867","0.0504","","","0.1176","0.1305","","","","","","0.847","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203846","7.269","0.003","7.632","0.003","14.345","0.006","78.664","0.008","86.234","0.008","69.542","0.007","731.1","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H20 As F6 O4 Se8 -","- C20 H20 As F6 O4 Se8 -","- C20 H20 As F6 O4 Se8 -","1","0.5","","Shirahata, Takashi; Kibune, Megumi; Imakubo, Tatsuro","New unsymmetrical donor dimethyl(ethylenedioxy)tetraselenafulvalene (DMEDO-TSeF): Structures and properties of its cation radical salts","Journal of Materials Chemistry","2005","15","41","4399","","10.1039/b511820d","","","0.71073","MoKα","","0.0963","0.0718","","","0.1872","0.1986","","","","","","0.942","","","","has coordinates,has disorder","180369","2020-10-21","18:00:00",""
"7203847","13.2971","0.0003","15.7128","0.0003","18.2835","0.0004","90","","106.925","0.0009","90","","3654.59","0.14","150","","150","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H44 Fe P2 Si -","- C42 H44 Fe P2 Si -","- C168 H176 Fe4 P8 Si4 -","4","1","","Miller, Catherine J.; O'Hare, Dermot","A new phosphine-functionalised [1]ferrocenophane and its use in the functionalisation of mesoporous silicas","Journal of Materials Chemistry","2005","15","47","5070","","10.1039/b513133b","","","0.71073","MoKα","","","0.0398","","","","0.0459","","","","","","1.0548","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203860","9.2457","0.0019","7.3465","0.0016","9.929","0.002","90","","100.702","0.005","90","","662.7","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[H3NC2H4NH2]TiOPO4","","","- C4 H18 N4 O10 P2 Ti2 -","- C4 H18 N4 O10 P2 Ti2 -","- C8 H36 N8 O20 P4 Ti4 -","2","0.5","","Zhao, Yongnan; Zhu, Guangshan; Jiao, Xiuling; Liu, Wang; Pang, Wenqin","Template synthesis and characterization of a new 2-D layered titanium phosphate","Journal of Materials Chemistry","2000","10","2","463","","10.1039/a904837e","","","0.71073","MoKα","","0.048","0.0331","","","0.0892","0.0985","","","","","","0.71","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203861","10.043","0.003","15.989","0.004","18.308","0.006","90","","90","","90","","2939.9","1.5","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C3 H16 Ga3 N2 O15 P3 -","- C3 Ga3 N2 O15 P3 -","- C24 Ga24 N16 O120 P24 -","8","1","","Chantal Brouca-Cabarrecq; Alain Mosset","New potential open-framework materials in gallophosphate systems. Preparation and crystal structure of [NH3(CH2)3NH3]Ga3(PO4)3(OH)2·H2O and [NH2(CH2)3NH2]Ga3(PO4)3(H2O)","J. Mater. Chem.","2000","10","2","445","450","10.1039/a905099j","","","0.7093","","","0.1277","0.0436","","0.1351","0.1164","","","","0.992","1.197","1.197","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203879","11.856","0.005","8.486","0.004","9.043","0.004","90","","106.89","0.01","90","","870.6","0.7","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 I4 N2 Pb -","- C6 H18 I4 N2 Pb -","- C12 H36 I8 N4 Pb2 -","2","0.5","","Mousdis, G. A.; Papavassiliou, G. C.; Raptopoulou, C. P.; Terzis, A.","Preparation and characterization of [H3N(CH2)6NH3]PbI4 and similar compounds with a layered perovskite structure","Journal of Materials Chemistry","2000","10","2","515","","10.1039/a906161d","","","0.71073","MoKα","","0.0298","0.0284","","0.0769","0.0758","","","","1.174","1.179","1.179","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203880","12.02","0.01","8.045","0.008","8.342","0.009","90","","105.66","0.03","90","","776.7","1.3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 Br4 N2 Pb -","- C6 Br4 N2 Pb -","- C12 Br8 N4 Pb2 -","2","0.5","","Mousdis, G. A.; Papavassiliou, G. C.; Raptopoulou, C. P.; Terzis, A.","Preparation and characterization of [H3N(CH2)6NH3]PbI4 and similar compounds with a layered perovskite structure","Journal of Materials Chemistry","2000","10","2","515","","10.1039/a906161d","","","0.71073","MoKα","","0.0427","0.0333","","0.0887","0.0828","","","","1.093","1.113","1.113","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7203893","15.46","0.005","16.781","0.007","15.429","0.006","115.28","0.03","90.88","0.03","90.88","0.03","3618","3","198.2","","198.2","","","","","","","","","4","P -1","-P 1","2","","","","- C86 H80 Mn N8 -","- C86 H80 Mn N8 -","- C172 H160 Mn2 N16 -","2","1","","Sugiura, Ken-ichi; Mikami, Shinji; Johnson, Mitchell T.; Miller, Joel S.; Iwasaki, Kentaro; Umishita, Kazunori; Hino, Shojun; Sakata, Yoshiteru","Structure and magnetic properties of meso-tetrakis(2,4,6-trimethylphenyl)porphyrinatomanganese(iii) 7,7,8,8-tetracyano-2,5-dimethyl-p-quinodimethanide with a 2.3 K Tc. The first example of cis coordination of a tetracyano-p-quinodimethanide","Journal of Materials Chemistry","2000","10","4","959","","10.1039/a907241a","","","0.7107","MoKα","","0.0756","0.0756","","","0.0926","0.0926","","","","","","1.384","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203910","10.337","0.002","15.297","0.0013","17.389","0.0006","90","","90","","90","","2749.6","0.6","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","N-[(2-Triphenylarsoniobenzylidene)]-1-amino-4-methoxybenzene iodide","","- C32 H27 As I N O -","- C32 H27 As I N O -","- C128 H108 As4 I4 N4 O4 -","4","1","","Allen, David W.; Mifflin, Joanne P.; Hursthouse, Michael B.; Coles, Simon; Hibbs, David E.; Malik, K. M. Abdul","A copper(i)-catalysed template synthesis of aryl-arsonium and -stibonium systems. Solvatochromic tetraaryl-arsonium and -stibonium iminophenolate betaines","Journal of Materials Chemistry","2000","10","2","457","","10.1039/a907699i","","","0.71069","MoKα","","0.0391","0.0326","","0.0766","0.0754","","","","0.881","0.947","0.947","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203911","42.77","0.003","12.461","0.0017","19.025","0.001","90","","107.861","0.005","90","","9650.8","1.6","","","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44 H76 N6 O10 -","- C44 H76 N6 O10 -","- C352 H608 N48 O80 -","8","1","","Nishimura, Kazukuni; Kondo, Tetsuo; Drozdova, Olga O.; Yamochi, Hideki; Saito, Gunzi","Preparation of metallic BEDT-TTF charge transfer complex of 3,3',5,5'-tetranitro-4,4'-biphenyldiol dianion (TNBP2−) having flexible molecular shape","Journal of Materials Chemistry","2000","10","4","911","","10.1039/a907746d","","","0.71073","MoKα","","0.0674","0.0674","","","0.1848","0.1848","","","","","","1.448","","","","has coordinates","192778","2020-10-21","18:00:00",""
"7203912","9.396","0.002","10.436","0.002","14.038","0.003","113.226","0.009","96.24","0.01","94.51","0.01","1246.3","0.5","","","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H44 N4 O10 P2 -","- C60 H44 N4 O10 P2 -","- C60 H44 N4 O10 P2 -","1","0.5","","Nishimura, Kazukuni; Kondo, Tetsuo; Drozdova, Olga O.; Yamochi, Hideki; Saito, Gunzi","Preparation of metallic BEDT-TTF charge transfer complex of 3,3',5,5'-tetranitro-4,4'-biphenyldiol dianion (TNBP2−) having flexible molecular shape","Journal of Materials Chemistry","2000","10","4","911","","10.1039/a907746d","","","0.71073","MoK-alpha","","","0.068","","","0.071","","","","","1.299","1.299","","","","","has coordinates","295880","2024-11-12","08:14:39",""
"7203913","8.692","0.001","12.936","0.001","16.208","0.002","97.376","0.009","96.234","0.009","103.888","0.009","1736","0.3","","","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H36 N4 O10 S32 -","- C52 H36 N4 O10 S32 -","- C52 H36 N4 O10 S32 -","1","0.5","","Nishimura, Kazukuni; Kondo, Tetsuo; Drozdova, Olga O.; Yamochi, Hideki; Saito, Gunzi","Preparation of metallic BEDT-TTF charge transfer complex of 3,3',5,5'-tetranitro-4,4'-biphenyldiol dianion (TNBP2−) having flexible molecular shape","Journal of Materials Chemistry","2000","10","4","911","","10.1039/a907746d","","","0.71073","MoK-alpha","","","0.065","","","0.063","","","","","2.308","2.308","","","","","has coordinates","295880","2024-11-12","08:14:39",""
"7203915","13.314","0.0019","13.314","0.0019","6.8188","0.0014","90","","90","","90","","1208.7","0.3","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","AlGe-NATROLITE","","","- Al1.87 Ge2.8 H2 Na2 O11.2 -","- Al1.865 Ge2.8 Na2 O12 -","- Al7.46 Ge11.2 Na8 O48 -","4","0.25","","Tripathi, Akhilesh; Johnson, Geoffrey M.; Jin Kim, Sun; Parise, John B.","Na2Al2Ge3O10·2H2O: an aluminogermanate with the tetranatrolite topology","Journal of Materials Chemistry","2000","10","2","451","","10.1039/a907933e","","","0.71073","MoKα","","0.0496","0.0463","","","0.1118","0.1132","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203925","12.369","0.003","13.674","0.002","12.38","0.0016","90","","90","","90","","2093.9","0.7","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C16 H32 Pd2 S2 -","- C16 H32 Pd2 S2 -","- C64 H128 Pd8 S8 -","4","0.5","","Singhal, A.; Jain, V. K.; Mishra, R.; Varghese, Babu","Organochalcogenido-bridged dimeric 2-methylallylpalladium complexes: synthesis, structure and their transformation into palladium chalcogenides","Journal of Materials Chemistry","2000","10","5","1121","","10.1039/a908133j","","","0.71073","MoKα","","0.0213","0.0184","","","0.0448","0.047","","","","","","1.189","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203926","8.148","0.001","15.388","0.002","22.658","0.003","96.086","0.009","96.34","0.01","95.26","0.011","2792.2","0.6","293","2","293","2","","","","","","","synthesis","4","P -1","-P 1","2","","","","- C114 H88 N40 Se6 -","- C114 H88 N40 Se6 -","- C114 H88 N40 Se6 -","1","0.5","","Devillanova, Francesco A.; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Verani, Gaetano; Cornia, Andrea; Fabretti, Antonio C.; Girlando, Alberto","Reaction of N,N'-dimethylimidazolidine-2-selone (4) with TCNQ. Characterisation and X-ray crystal structure of the mixed-valence compound 4·(TCNQ)1.167","Journal of Materials Chemistry","2000","10","6","1281","","10.1039/a908136d","","","0.71069","MoKα","","0.0849","0.0442","","","0.1006","0.1274","","","","","","1.055","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203940","10.8001","0.0009","11.016","0.0009","12.4143","0.0009","107.851","0.005","100.953","0.005","96.477","0.007","1356.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C66 H44 Cl4 O8 -","- C66 H40 Cl4 O8 -","- C66 H40 Cl4 O8 -","1","0.5","","Baxter, Ian; Colquhoun, Howard M.; Hodge, Philip; Kohnke, Franz H.; Lewis, David F.; Williams, David J.","Macrocyclic oligomers of the aromatic polyetherketone “PK99”: synthesis, fractionation, structural characterisation and ring-opening polymerisation","Journal of Materials Chemistry","2000","10","2","309","","10.1039/a908414b","","","1.54178","CuKα","","0.0832","0.0638","","0.2081","0.1754","","","","1.042","1.092","1.092","","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203946","11.953","0.004","14.701","0.002","13.917","0.004","90","","93.77","0.02","90","","2440.2","1.1","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 Cl O4 S12 -","- C15 H8 Cl O4 S12 -","- C60 H32 Cl4 O16 S48 -","4","1","","Le Moustarder, S.; Hudhomme, P.; Durand, C.; Mercier, N.; Azcondo, M. T.; Delhaes, P.; Riou, A.; Gorgues, A.","First radical cation salts from the symmetrical outer S‐position isomer of BEDT-TTF","Journal of Materials Chemistry","2000","10","3","617","","10.1039/a908843a","","","0.71073","Mo-Kα","","0.067","0.051","","0.086","0.08","","","","2.229","2.122","2.122","","","","","has coordinates","288529","2023-12-23","19:34:17",""
"7203947","11.91","0.008","14.579","0.008","13.771","0.002","90","","94.28","0.02","90","","2384","2","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 B F4 S12 -","- C15 H11.44 B F4 S12 -","- C60 H45.76 B4 F16 S48 -","4","1","","Le Moustarder, S.; Hudhomme, P.; Durand, C.; Mercier, N.; Azcondo, M. T.; Delhaes, P.; Riou, A.; Gorgues, A.","First radical cation salts from the symmetrical outer S‐position isomer of BEDT-TTF","Journal of Materials Chemistry","2000","10","3","617","","10.1039/a908843a","","","0.71073","Mo-Kα","","0.065","0.048","","0.061","0.05","","","","2.354","2.012","2.012","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203948","5.417","0.007","17.75","0.01","20.71","0.01","90","","96.94","0.02","90","","1977","3","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H4 Cu N2 S10 -","- C12 H4 Cu N2 S10 -","- C48 H16 Cu4 N8 S40 -","4","1","","Le Moustarder, S.; Hudhomme, P.; Durand, C.; Mercier, N.; Azcondo, M. T.; Delhaes, P.; Riou, A.; Gorgues, A.","First radical cation salts from the symmetrical outer S‐position isomer of BEDT-TTF","Journal of Materials Chemistry","2000","10","3","617","","10.1039/a908843a","","","0.71073","Mo-Kα","","0.203","0.056","","0.352","0.069","","","","","1.418","1.418","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203949","45.381","0.001","5.1771","0.0007","18.266","0.001","90","","106.293","0.006","90","","4119.1","0.6","298","2","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","Dibenzo[fg,ij]phenanthro[3,2,1,10,9-pqrst]pentaphene","","- C36 H18 -","- C36 H18 -","- C288 H144 -","8","1","","Kübel, Christian; Eckhardt, Karin; Enkelmann, Volker; Wegner, Gerhard; Müllen, Klaus","Synthesis and crystal packing of large polycyclic aromatic hydrocarbons: hexabenzo[bc,ef,hi,kl,no,qr]coronene and dibenzo[fg,ij]phenanthro[9,10,1,2,3-pqrst]pentaphene","Journal of Materials Chemistry","2000","10","4","879","","10.1039/a908941a","","","1.5418","CuKα","","","0.047","","","0.057","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203951","21.722","0.002","21.722","0.002","7.448","0.002","90","","90","","90","","3514.3","1","291.2","","293","","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C92 H52 Fe2 N20 P -","- C92 H52 Fe2 N20 P -","- C184 H104 Fe4 N40 P2 -","2","0.25","","Matsuda, Masaki; Naito, Toshio; Inabe, Tamotsu; Hanasaki, Noriaki; Tajima, Hiroyuki; Otsuka, Takeo; Awaga, Kunio; Narymbetov, Bakhyt; Kobayashi, Hayao","A one-dimensional macrocyclic π‐ligand conductor carrying a magnetic center. Structure and electrical, optical and magnetic properties of TPP[Fe(Pc)(CN)2]2 {TPP = tetraphenylphosphonium and [Fe(Pc)(CN)2] = dicyano(phthalocyaninato)iron(iii)}","Journal of Materials Chemistry","2000","10","3","631","","10.1039/a909159i","","","0.7107","MoKα","","0.0358","0.0358","","","0.0385","0.0385","","","","","","2.45","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203952","5.0715","0.0006","7.5286","0.0011","9.1496","0.0011","72.441","0.003","85.679","0.002","70.48","0.002","313.8","0.07","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C2 H14 F Fe N2 Nb O11 P2 -","- C2 H14 F Fe N2 Nb O11 P2 -","- C2 H14 F Fe N2 Nb O11 P2 -","1","0.5","","Wang, Xiqu; Liu, Lumei; Cheng, Heidi; Ross, Kent; Jacobson, Allan J.","Synthesis and crystal structures of [H3N(CH2)2NH3]NbMOF(PO4)2(H2O)2, M = Fe,Co and [H3N(CH2)2NH3]Ti(Fe0.9Cr0.1)(F1.3O0.7)(H0.3PO4)2(H2O)2","Journal of Materials Chemistry","2000","10","5","1203","","10.1039/a909193i","","","0.71073","MoKα","","0.049","0.0473","","0.1138","0.1131","","","","1.313","1.331","1.331","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203953","5.0469","0.0005","7.487","0.0008","9.1217","0.001","72.486","0.002","85.679","0.002","70.8","0.002","310.31","0.06","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C2 H14 Co F N2 Nb O11 P2 -","- C2 H14 Co F N2 Nb O11 P2 -","- C2 H14 Co F N2 Nb O11 P2 -","1","0.5","","Wang, Xiqu; Liu, Lumei; Cheng, Heidi; Ross, Kent; Jacobson, Allan J.","Synthesis and crystal structures of [H3N(CH2)2NH3]NbMOF(PO4)2(H2O)2, M = Fe,Co and [H3N(CH2)2NH3]Ti(Fe0.9Cr0.1)(F1.3O0.7)(H0.3PO4)2(H2O)2","Journal of Materials Chemistry","2000","10","5","1203","","10.1039/a909193i","","","0.71073","MoKα","","0.0599","0.0569","","0.1337","0.1323","","","","1.312","1.327","1.327","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203954","5.1584","0.001","7.4556","0.0014","9.089","0.002","63.87","0.03","80.6","0.03","69.79","0.03","294.48","0.14","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C2 H14.3 Cr0.1 F1.3 Fe0.9 N2 O10.7 P2 Ti -","- C H5 Cr0.07 F0.65 Fe0.43 N O5.35 P Ti0.5 -","- C2 H10 Cr0.14 F1.3 Fe0.86 N2 O10.7 P2 Ti -","2","1","","Wang, Xiqu; Liu, Lumei; Cheng, Heidi; Ross, Kent; Jacobson, Allan J.","Synthesis and crystal structures of [H3N(CH2)2NH3]NbMOF(PO4)2(H2O)2, M = Fe,Co and [H3N(CH2)2NH3]Ti(Fe0.9Cr0.1)(F1.3O0.7)(H0.3PO4)2(H2O)2","Journal of Materials Chemistry","2000","10","5","1203","","10.1039/a909193i","","","0.71073","MoKα","","0.1548","0.0976","","0.2413","0.2103","","","","1.076","1.186","1.186","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203958","12.432","0.001","12.893","0.001","22.148","0.002","90","","90","","90","","3550.01","","160","","0","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C42 H42 N4 O2 -","- C42 H42 N4 O2 -","- C168 H168 N16 O8 -","4","1","","Averseng, Frédéric; Lacroix, Pascal G.; Malfant, Isabelle; Dahan, Françoise; Nakatani, Keitaro","Synthesis, crystal structure and solid state NLO properties of a new chiral bis(salicylaldiminato)nickel(ii) Schiff-base complex in a nearly optimized solid state environment","Journal of Materials Chemistry","2000","10","4","1013","","10.1039/a910244m","","","0.71073","MoKα","","","0.0913","","","0.08","","","","","1.1412","1.1412","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7203959","13.66","0.002","10.601","0.002","12.34","0.002","90","","112.086","0.011","90","","1655.83","","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C36 H40 N4 Ni O2 -","- C36 H40 N4 Ni O2 -","- C72 H80 N8 Ni2 O4 -","2","1","","Averseng, Frédéric; Lacroix, Pascal G.; Malfant, Isabelle; Dahan, Françoise; Nakatani, Keitaro","Synthesis, crystal structure and solid state NLO properties of a new chiral bis(salicylaldiminato)nickel(ii) Schiff-base complex in a nearly optimized solid state environment","Journal of Materials Chemistry","2000","10","4","1013","","10.1039/a910244m","","","0.71073","MoKα","","0.0509","0.0352","","0.0632","0.0568","","","","1.076","1.115","1.115","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203960","12.9998","0.001","16.1021","0.0016","36.377","0.003","90","","90","","90","","7614.58","","180","","180","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C88 H88 N8 Ni3 O9 -","- C88 H88 N8 Ni3 O9 -","- C352 H352 N32 Ni12 O36 -","4","1","","Averseng, Frédéric; Lacroix, Pascal G.; Malfant, Isabelle; Dahan, Françoise; Nakatani, Keitaro","Synthesis, crystal structure and solid state NLO properties of a new chiral bis(salicylaldiminato)nickel(ii) Schiff-base complex in a nearly optimized solid state environment","Journal of Materials Chemistry","2000","10","4","1013","","10.1039/a910244m","","","0.71073","MoKα","","0.1035","0.0776","","","0.1862","0.208","","","","","","1.025","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203961","17.776","0.005","18.613","0.009","10.124","0.003","90","","123.51","0.03","90","","2793","2","296.2","","296.2","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C54 H36 Cl4 N10 O12 Zn2 -","- C27 H18 Cl2 N5 O6 Zn0.5 -","- C108 H72 Cl8 N20 O24 Zn2 -","4","1","","Evans, Cara C.; Masse, René; Nicoud, Jean-François; Bagieu-Beucher, Muriel","A new octupolar material for quadratic nonlinear optics: tris(2,2'-bipyridyl)Zn(ii) tetrakis(2-chloro-4-nitrophenolate)Zn(ii)","Journal of Materials Chemistry","2000","10","6","1419","","10.1039/b000417k","","","0.7107","MoKα","","0.0356","0.036","","0.039","","0.039","","","1.436","","","1.44","","","","has coordinates","277931","2022-09-16","22:15:54",""
"7203962","11.2655","0.0006","16.7247","0.0008","9.6229","0.0004","94.18","0.003","109","1","106.026","0.003","1621","12","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H22 Cl2 N6 O6 Zn -","- C32 H22 Cl2 N6 O6 Zn -","- C64 H44 Cl4 N12 O12 Zn2 -","2","1","","Evans, Cara C.; Masse, René; Nicoud, Jean-François; Bagieu-Beucher, Muriel","A new octupolar material for quadratic nonlinear optics: tris(2,2'-bipyridyl)Zn(ii) tetrakis(2-chloro-4-nitrophenolate)Zn(ii)","Journal of Materials Chemistry","2000","10","6","1419","","10.1039/b000417k","","","0.5608","AgKα","","0.0314","0.031","","0.046","","0.046","","","2.99","","","2.99","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203963","13.1589","0.0006","13.3044","0.0009","11.9989","0.0008","94.1","1","115","1","91.107","0.003","1896","16","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H16 Cl2 N2 O11 Zn -","- C12 H15.5 Cl2 N2 O11 Zn -","- C48 H62 Cl8 N8 O44 Zn4 -","4","2","","Evans, Cara C.; Masse, René; Nicoud, Jean-François; Bagieu-Beucher, Muriel","A new octupolar material for quadratic nonlinear optics: tris(2,2'-bipyridyl)Zn(ii) tetrakis(2-chloro-4-nitrophenolate)Zn(ii)","Journal of Materials Chemistry","2000","10","6","1419","","10.1039/b000417k","","","0.5608","AgKα","","0.0431","0.043","","0.052","","0.052","","","1.983","","","1.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203964","7.4876","0.0008","8.2336","0.0008","12.8592","0.0013","98.723","0.002","101.258","0.002","115.785","0.002","674.51","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H14 N2 O12 P3 Zn2 -","- C3 H14 N2 O12 P3 Zn2 -","- C6 H28 N4 O24 P6 Zn4 -","2","1","","Liu, Wang; Liu, Yunling; Shi, Zhan; Pang, Wenqin","Hydrothermal synthesis and characterization of a new layered zinc phosphate intercalated with fully-protonated triethylenetetramine [Zn2(HPO4)3]2−[(C6N4H22)0.5]2+","Journal of Materials Chemistry","2000","10","6","1451","","10.1039/b000658k","","","0.71073","MoKα","","0.0627","0.0596","","","0.1521","0.1548","","","","","","1.084","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203965","11.1071","0.0005","25.4188","0.0009","12.5938","0.0005","90","","96.911","0.007","90","","3529.8","0.3","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H34 Cl2 O8 -","- C42 H34 Cl2 O8 -","- C168 H136 Cl8 O32 -","4","1","","Ben-Haida, Abderrazak; Colquhoun, Howard M.; Hodge, Philip; Williams, David J.","Cyclic oligomers of poly(ether ketone) (PEK): synthesis, extraction from polymer, fractionation, and characterisation of the cyclic trimer, tetramer and pentamer","Journal of Materials Chemistry","2000","10","9","2011","","10.1039/b000738m","","","1.54178","CuKα","","0.0647","0.0514","","0.1471","0.1338","","","","1.037","1.075","1.075","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203966","8.7603","0.0005","10.1072","0.0005","14.0404","0.0008","75.262","0.004","73.004","0.005","80.202","0.004","1143.57","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C53.5 H35 Cl3 O8 -","- C53.5 H35 Cl3 O8 -","- C53.5 H35 Cl3 O8 -","1","0.5","","Ben-Haida, Abderrazak; Colquhoun, Howard M.; Hodge, Philip; Williams, David J.","Cyclic oligomers of poly(ether ketone) (PEK): synthesis, extraction from polymer, fractionation, and characterisation of the cyclic trimer, tetramer and pentamer","Journal of Materials Chemistry","2000","10","9","2011","","10.1039/b000738m","","","1.54178","CuKα","","0.0815","0.0609","","0.2084","0.1741","","","","1.07","1.124","1.124","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203967","8.374","0.001","12.684","0.002","26.295","0.003","90","","96.2","0.01","90","","2776.6","0.6","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-bis[4',5,5'-tris(methylsulfanyl)tetrathiafulvalenyl]","","- C18 H18 S14 -","- C18 H18 S14 -","- C72 H72 S56 -","4","1","","John, Derek E.; Moore, Adrian J.; Bryce, Martin R.; Batsanov, Andrei S.; Leech, Michael A.; Howard, Judith A. K.","New bi(tetrathiafulvalenyl) derivatives and their radical cations: synthetic and X-ray structural studies","Journal of Materials Chemistry","2000","10","6","1273","","10.1039/b000790k","","","0.71073","MoKα","","0.0465","0.042","","0.1194","0.1145","","","","1.187","1.203","1.203","","","","","has coordinates,has disorder","288193","2023-12-08","17:12:24",""
"7203968","11.074","0.003","24.139","0.007","4.876","0.002","90","","90","","90","","1303.4","0.7","150","2","150","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","4-bis(5-methyl-4',5'-ethylenedithiotetrathiafulvalenyl) perchlorate","","- C18 H14 Cl O4 S12 -","- C18 H14 Cl O4 S12 -","- C36 H28 Cl2 O8 S24 -","2","0.5","","John, Derek E.; Moore, Adrian J.; Bryce, Martin R.; Batsanov, Andrei S.; Leech, Michael A.; Howard, Judith A. K.","New bi(tetrathiafulvalenyl) derivatives and their radical cations: synthetic and X-ray structural studies","Journal of Materials Chemistry","2000","10","6","1273","","10.1039/b000790k","","","1.54184","CuKα","","0.1737","0.1276","","0.4067","0.3278","","","","1.063","1.098","1.098","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203970","7.234","0.001","8.999","0.001","16.907","0.002","90","","92.42","0.01","90","","1099.6","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N2 O3 -","- C12 H10 N2 O3 -","- C48 H40 N8 O12 -","4","1","","Zhao, Bo; Chen, Changyun; Zhou, Zhihua; Cao, Yang; Li, Ming","A comparative study on the nonlinear optical properties of diphenyl ether and diphenyl sulfide compounds","Journal of Materials Chemistry","2000","10","7","1581","","10.1039/b000957l","","","0.71073","MoKα","","0.0577","0.0322","","","0.077","0.0834","","","","","","0.905","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203971","9.929","0.002","19.549","0.004","12.1","0.002","90","","96.11","0.03","90","","2335.3","0.8","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 N2 O5 S -","- C24 H30 N2 O5 S -","- C96 H120 N8 O20 S4 -","4","1","","Ren, Yan; Fang, Qi; Yu, Wen-Tao; Lei, Hong; Tian, Yu-Peng; Jiang, Min-Hua; Yang, Qing-Chuan; Mak, Thomas C. W.","Synthesis, structures and two-photon pumped up-conversion lasing properties of two new organic salts","Journal of Materials Chemistry","2000","10","9","2025","","10.1039/b001058h","","","0.71073","MoKα","","0.0811","0.0776","","","0.2303","0.2347","","","","","","1.091","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7203972","9.4237","0.0008","9.6976","0.0008","13.2841","0.0009","86.655","0.006","74.064","0.005","85.891","0.007","1163.39","0.16","568","2","568","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H30 N2 O4 S -","- C25 H30 N2 O4 S -","- C50 H60 N4 O8 S2 -","2","1","","Ren, Yan; Fang, Qi; Yu, Wen-Tao; Lei, Hong; Tian, Yu-Peng; Jiang, Min-Hua; Yang, Qing-Chuan; Mak, Thomas C. W.","Synthesis, structures and two-photon pumped up-conversion lasing properties of two new organic salts","Journal of Materials Chemistry","2000","10","9","2025","","10.1039/b001058h","","","0.71073","MoKα","","0.0842","0.0573","","","0.1575","0.1832","","","","","","0.987","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203973","9.733","0.001","20.826","0.002","25.311","0.003","74.97","0.01","83.31","0.02","89.26","0.02","4920.5","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 Cl3 In N3 -","- C21 H27 Cl3 In N3 -","- C168 H216 Cl24 In8 N24 -","8","4","","Green, Mark; Norager, Sebastian; Moriarty, Philip; Motevalli, Majid; O'Brien, Paul","On the synthesis and manipulation of InAs quantum dots","Journal of Materials Chemistry","2000","10","8","1939","","10.1039/b001354o","","","0.71073","MoKα","","0.2443","0.0953","","","0.2874","0.3465","","","","","","0.825","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203974","19.503","0.004","10.841","0.003","24.137","0.005","90","","97.13","0.03","90","","5064","2","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","TBA[Ni(fcvdt)2](COMe2)0.5","","","- C45.5 H59 Fe2 N Ni O0.5 S8 -","- C45.5 H56 Fe2 N Ni O0.5 S8 -","- C182 H224 Fe8 N4 Ni4 O2 S32 -","4","1","","Lee, Ha-Jin; Noh, Dong-Youn","Syntheses, X-ray crystal structures and properties of di- and tetra-ferrocenyl nickel-bis(1,4-dithiin-5,6-dithiolate) complexes","Journal of Materials Chemistry","2000","10","9","2167","","10.1039/b001829p","","","0.71073","MoKα","","0.0793","0.0772","","","0.1971","0.2003","","","","","","1.09","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203975","20.457","0.014","39.22","0.013","8.496","0.002","90","","90","","90","","6817","5","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","TBA[Ni(dfcvdt)2](COMe2)","","","- C67 H78 Fe4 N Ni O S8 -","- C67 H36 Fe4 N Ni O S8 -","- C268 H144 Fe16 N4 Ni4 O4 S32 -","4","0.5","","Lee, Ha-Jin; Noh, Dong-Youn","Syntheses, X-ray crystal structures and properties of di- and tetra-ferrocenyl nickel-bis(1,4-dithiin-5,6-dithiolate) complexes","Journal of Materials Chemistry","2000","10","9","2167","","10.1039/b001829p","","","0.71073","MoKα","","0.2474","0.1093","","","0.2571","0.3047","","","","","","1.037","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203976","6.438","0.001","19.151","0.002","3.93","0.001","92.69","0.02","95.76","0.02","93.7","0.01","480.4","0.15","293.2","","293.2","","","","","","","","","6","P 1","P 1","1","","","","- C12 H6 F2 S4 Se4 Ta0.33 -","- C12 H6 F1.98 S4 Se4 Ta0.33 -","- C12 H6 F1.98 S4 Se4 Ta0.33 -","1","1","","Fujiwara, Hideki; Misaki, Yohji; Yamabe, Tokio; Mori, Takehiko; Mori, Hatsumi; Tanaka, Shoji","Preparation, structures and physical properties of selenium analogues of DTEDT as promising donors for organic metals","Journal of Materials Chemistry","2000","10","7","1565","","10.1039/b002790l","","","0.7107","MoKα","","","0.0434","","","0.0474","","","","","2.364","2.364","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203977","9.41","","10.004","","18.881","","79.891","","85.382","","89.057","","1744.13","","120","","120","","","","","","","","","6","P -1","-P 1","2","","bismuthcalciumvanadate","","- C0 H0 Bi3.03 Ca8.97 O41 V11 -","- Bi3.035 Ca8.965 O41 V11 -","- Bi6.07 Ca17.93 O82 V22 -","2","1","","Radosavljevic, Ivana; Howard, Judith A. K.; Sleight, Arthur W.; Evans, John S. O.","Synthesis and structure of Bi3Ca9V11O41","Journal of Materials Chemistry","2000","10","9","2091","","10.1039/b002857f","","","0.71073","MoKα","","","0.0393","","","","0.0411","","","","","","0.6348","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203978","12.783","0.002","28.839","0.005","7.3919","0.0009","90","","90","","90","","2725","0.7","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H34 Cu2 N2 O8 -","- C26 H34 Cu2 N2 O8 -","- C104 H136 Cu8 N8 O32 -","4","1","","Royles, Brodyck J. L.; Sherrington, David C.","Mainchain optically active vinyl copolymers via transition metal complex-templated asymmetric free radical polymerisation","Journal of Materials Chemistry","2000","10","9","2035","","10.1039/b003007o","","","0.61079","","","0.0684","0.0375","","","0.089","0.0981","","","","","","1.026","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203979","8.9908","0.0005","13.2399","0.0005","15.0602","0.001","81.003","0.004","85.747","0.003","70.911","0.003","1672.79","0.16","293","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H24 Cl O4 S16 -","- C24 H24 Cl O4 S16 -","- C48 H48 Cl2 O8 S32 -","2","1","","Li, Hongxiang; Zhang, Deqing; Zhang, Bin; Yao, Youxin; Xu, Wei; Zhu, Daoben; Wang, Zhemin","Syntheses of new electron donors with hydroxymethyl groups and studies on their cation-radical salts","Journal of Materials Chemistry","2000","10","9","2063","","10.1039/b003041o","","","0.71073","MoKα","","0.1107","0.0825","","","0.2","0.2093","","","","","","1.239","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203980","5.2475","0.0009","13.795","0.002","11.689","0.002","90","","90","","90","","846.2","0.2","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- Co F Na2 O4 P -","- Co F Na2 O4 P -","- Co8 F8 Na16 O32 P8 -","8","1","","Sanz, Francisca; Parada, Carmen; Ruíz-Valero, Caridad","Crystal growth, crystal structure and magnetic properties of disodium cobalt fluorophosphate","Journal of Materials Chemistry","2001","11","1","208","","10.1039/b003150j","","","0.71073","MoKα","","0.1122","0.0632","","0.2624","0.1824","","","","1.061","0.923","0.923","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203983","13.795","0.003","12.83","0.003","18.815","0.005","90","","89.959","0.007","90","","3330.1","1.4","150","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C1.05 Al N0.35 O4 P -","- C1.05 Al N0.35 O4 P -","- C25.2 Al24 N8.4 O96 P24 -","24","3","","Maple, Martin J.; Philp, Eilidh F.; Slawin, Alexandra M. Z.; Lightfoot, Philip; Cox, Paul A.; Wright, Paul A.","Azamacrocycles and the azaoxacryptand 4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane as structure-directing agents in the synthesis of microporous metalloaluminophosphates","Journal of Materials Chemistry","2001","11","1","98","104","10.1039/b003430o","","","0.6942","MonochromatedX-raysynchrotronradiation","","","0.0837","","","0.1056","","","","","3.344","3.344","","","","","has coordinates,has disorder","277935","2022-09-17","00:24:27",""
"7203984","14.978","0.0008","14.72","0.0008","8.4792","0.0005","90","","98.323","0.001","90","","1849.77","0.18","293","2","293","2","","","","","","","-","7","P 1 21/c 1","-P 2ybc","14","","","","- C10 H25 Al Co N4 O8 P2 -","- C10 H25 Al Co N4 O8 P2 -","- C40 H100 Al4 Co4 N16 O32 P8 -","4","1","","Maple, Martin J.; Philp, Eilidh F.; Slawin, Alexandra M. Z.; Lightfoot, Philip; Cox, Paul A.; Wright, Paul A.","Azamacrocycles and the azaoxacryptand 4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane as structure-directing agents in the synthesis of microporous metalloaluminophosphates","Journal of Materials Chemistry","2001","11","1","98","104","10.1039/b003430o","","","0.71073","MoKα","","0.0435","0.0285","","0.0818","0.0643","","","","0.984","1.042","1.042","","","","","has coordinates","277932","2022-09-16","23:04:30",""
"7203985","23.99","0.008","23.99","0.008","23.99","0.008","90","","90","","90","","13807","8","150","","150","","","","","","","","","6","F m -3 c","-F 4a 2 3","226","","","","- C1.5 Al0.8 N0.17 O4.5 P Zn0.2 -","- C2.66983 Al0.8 N0.332 O4.996 P Zn0.2 -","- C256.304 Al76.8 N31.872 O479.616 P96 Zn19.2 -","96","0.5","","Maple, Martin J.; Philp, Eilidh F.; Slawin, Alexandra M. Z.; Lightfoot, Philip; Cox, Paul A.; Wright, Paul A.","Azamacrocycles and the azaoxacryptand 4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane as structure-directing agents in the synthesis of microporous metalloaluminophosphates","Journal of Materials Chemistry","2001","11","1","98","104","10.1039/b003430o","","","0.6942","MonochromatedsynchrotronX-rays","","","0.1233","","","0.1329","","","","","8.098","8.098","","","","","has coordinates,has disorder","277936","2022-09-17","11:45:58",""
"7203986","4.0251","0.0003","15.266","0.002","19.259","0.002","97.02","0.01","93.23","0.01","96.04","0.01","1165.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16.875 H12 Fe0.375 N2.25 O6.375 S6 -","- C16.875 H12 Fe0.375 N2.25 O6.375 S6 -","- C33.75 H24 Fe0.75 N4.5 O12.75 S12 -","2","1","","Zorina, Leokadiya V.; Khasanov, Salavat S.; Shibaeva, Rimma P.; Gener, Marc; Rousseau, Roger; Canadell, Enric; Kushch, Lyudmila A.; Yagubskii, Eduard B.; Drozdova, Olga O.; Yakushi, Kyuya","A new stable organic metal based on the BEDO-TTF donor and the doubly charged nitroprusside anion, (BEDO-TTF)4[Fe(CN)5NO]","Journal of Materials Chemistry","2000","10","9","2017","","10.1039/b003433i","","","0.71073","MoKα","","0.0753","0.0707","","","0.2303","0.2383","","","","","","0.999","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203987","10.245","0.0016","12.6915","0.0019","13.557","0.002","80.371","0.003","87","0.003","85.967","0.003","1732.1","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H29 Br6 N5 O3 -","- C33 H29 Br6 N5 O3 -","- C66 H58 Br12 N10 O6 -","2","1","","Robertson, Neil; Parsons, S.; MacLean, E. J.; Coxall, R. A.; Mount, Andrew R.","Preparation, X-ray structure and properties of a hexabrominated, symmetric indole trimer and its TCNQ adduct: a new route to functional molecular systems","Journal of Materials Chemistry","2000","10","9","2043","","10.1039/b003631p","","","0.6884","synchrotron","","0.1077","0.0654","","","0.1457","0.1581","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203988","14.455","0.003","25.371","0.005","16.719","0.003","90","","93.24","0.03","90","","6122","2","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H41 Br6 N11 O4 S4 -","- C54 H35 Br6 N11 O3 S3 -","- C216 H140 Br24 N44 O12 S12 -","4","1","","Robertson, Neil; Parsons, S.; MacLean, E. J.; Coxall, R. A.; Mount, Andrew R.","Preparation, X-ray structure and properties of a hexabrominated, symmetric indole trimer and its TCNQ adduct: a new route to functional molecular systems","Journal of Materials Chemistry","2000","10","9","2043","","10.1039/b003631p","","","1.54178","CuKα","","0.1807","0.0868","","","0.2021","0.2476","","","","","","0.955","","","","has coordinates,has disorder","180370","2020-10-21","18:00:00",""
"7203989","4.8898","0.0005","9.0758","0.001","9.521","0.001","88.815","0.002","78.638","0.002","78.491","0.002","405.84","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Ba3 Nb2 O18 P4 -","- Ba3 Nb2 O18 P4 -","- Ba3 Nb2 O18 P4 -","1","0.5","","Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.","Hydrothermal synthesis and structures of Ba3(NbO)2(PO4)4 and Co3(NbO)2(PO4)4(H2O)10","Journal of Materials Chemistry","2000","10","12","2774","","10.1039/b003845h","","","0.71073","MoKα","","0.0738","0.055","","0.1428","0.133","","","","0.997","1.053","1.053","","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203990","5.1259","0.0003","11.1573","0.0008","19.1666","0.0013","90","","90.171","0.001","90","","1096.16","0.13","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Co3 F0.3 H19.7 Nb2 O27.7 P4 -","- Co3 Nb2 O28 P4 -","- Co6 Nb4 O56 P8 -","2","0.5","","Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.","Hydrothermal synthesis and structures of Ba3(NbO)2(PO4)4 and Co3(NbO)2(PO4)4(H2O)10","Journal of Materials Chemistry","2000","10","12","2774","","10.1039/b003845h","","","0.71073","MoKα","","0.0687","0.0488","","0.1174","0.1096","","","","0.975","1.032","1.032","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203991","6.876","0.002","9.361","0.003","9.508","0.003","101.96","0.01","95.96","0.01","104.09","0.01","573","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","thieno[3',4'-d:5,6][1,4]dithiino[2,3-b]quinoxaline","","- C12 H6 N2 S3 -","- C12 H6 N2 S3 -","- C24 H12 N4 S6 -","2","1","","Skabara, Peter J.; Berridge, Rory; Prescott, Karen; Goldenberg, Leonid M.; Ortí, Enrique; Viruela, Rafael; Pou-Amérigo, Rosendo; Batsanov, Andrei S.; Howard, Judith A. K.; Coles, Simon J.; Hursthouse, Michael B.","Experimental and theoretical studies into the structural perturbations between neutral, oxidised and reduced forms of 1,4-dithiinoquinoxaline derivatives","Journal of Materials Chemistry","2000","10","11","2448","","10.1039/b003910l","","","0.71073","MoKα","","0.0313","0.0286","","0.0819","0.0764","","","","1.121","1.119","1.119","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203992","8.059","0.001","12.144","0.001","22.257","0.002","76.95","0.01","85.24","0.01","79.67","0.01","2085.6","0.4","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","thieno[3',4'-d:5,6][1,4]dithiino[2,3-b]quinoxaline tetracyanoquinodimethane","","- C24 H10 N6 S3 -","- C24 H10 N6 S3 -","- C96 H40 N24 S12 -","4","2","","Skabara, Peter J.; Berridge, Rory; Prescott, Karen; Goldenberg, Leonid M.; Ortí, Enrique; Viruela, Rafael; Pou-Amérigo, Rosendo; Batsanov, Andrei S.; Howard, Judith A. K.; Coles, Simon J.; Hursthouse, Michael B.","Experimental and theoretical studies into the structural perturbations between neutral, oxidised and reduced forms of 1,4-dithiinoquinoxaline derivatives","Journal of Materials Chemistry","2000","10","11","2448","","10.1039/b003910l","","","0.71073","MoKα","","0.106","0.0675","","","0.1594","0.1928","","","","","","1.09","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7203993","9.5292","0.0019","13.975","0.003","10.241","0.002","90","","90","","90","","1363.8","0.5","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","5,6-bis(methylsulfanyl)[1,4]dithiino[2,3-b]quinoxaline","","- C12 H10 N2 S4 -","- C12 H10 N2 S4 -","- C48 H40 N8 S16 -","4","0.5","","Skabara, Peter J.; Berridge, Rory; Prescott, Karen; Goldenberg, Leonid M.; Ortí, Enrique; Viruela, Rafael; Pou-Amérigo, Rosendo; Batsanov, Andrei S.; Howard, Judith A. K.; Coles, Simon J.; Hursthouse, Michael B.","Experimental and theoretical studies into the structural perturbations between neutral, oxidised and reduced forms of 1,4-dithiinoquinoxaline derivatives","Journal of Materials Chemistry","2000","10","11","2448","","10.1039/b003910l","","","0.71073","MoKα","","0.0518","0.0443","","","0.1085","0.1126","","","","","","0.796","","","","has coordinates","180370","2020-10-21","18:00:00",""
"7204000","9.864","0.002","12.475","0.004","8.827","0.002","107.83","0.02","93.02","0.02","102.3","0.02","1002.1","0.5","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C52 H27 Co N11 -","- C52 H24 Co N11 -","- C52 H24 Co N11 -","1","0.5","","Matsumura, Naoko; Fujita, Akiko; Naito, Toshio; Inabe, Tamotsu","Multi-dimensional π‒π stacking interaction in neutral radical crystals obtained by electrochemical oxidation of [CoIII(2,3-Nc)(CN)2]− (2,3-Nc = 2,3-naphthalocyanine)","Journal of Materials Chemistry","2000","10","10","2266","","10.1039/b004025h","","","0.7107","MoKα","","","0.0724","","","","0.08","","","","","","3.44","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204001","10.684","0.001","15.005","0.002","8.068","0.001","92.371","0.007","95.72","0.006","70.079","0.004","1209.9","0.2","123","","","","","","","","","","","5","P -1","-P 1","2","","","","- C62 H32 Cl4 Co N10 -","- C62 H32 Cl4 Co N10 -","- C62 H32 Cl4 Co N10 -","1","0.5","","Matsumura, Naoko; Fujita, Akiko; Naito, Toshio; Inabe, Tamotsu","Multi-dimensional π‒π stacking interaction in neutral radical crystals obtained by electrochemical oxidation of [CoIII(2,3-Nc)(CN)2]− (2,3-Nc = 2,3-naphthalocyanine)","Journal of Materials Chemistry","2000","10","10","2266","","10.1039/b004025h","","","0.7107","MoKα","","","0.0645","","","","0.045","","","","","","2.36","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204002","17.2497","0.0013","25.7851","0.0018","9.4339","0.0007","90","","103.567","","90","","4079","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C140 H141 Al12 O64 P20 -","- C142.08 H134 Al12 O64 P20 -","- C142.08 H134 Al12 O64 P20 -","1","0.25","","Zakowsky, Nadja; Hix, Gary B.; Morris, Russell E.","Synthesis of a family of aluminium benzylphosphonates","Journal of Materials Chemistry","2000","10","10","2375","","10.1039/b004177g","","","0.6944","Synchrotron","","0.1349","0.0835","","","0.1819","0.202","","","","","","1.197","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204004","20.944","0.005","9.861","0.002","9.404","0.002","90","","95.61","0.02","90","","1932.9","0.7","296.2","","296.2","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C11 H11 B F4 N O S8 -","- C11 H7 B F4 N O S8 -","- C44 H28 B4 F16 N4 O4 S32 -","4","1","","Ono, Go; Terao, Hiroshi; Higuchi, Saburo; Sugawara, Tadashi; Izuoka, Akira; Mochida, Tomoyuki","One-dimensional double chain composed of carbamoylmethylthio-substituted TTF-based donor in ion radical salt","Journal of Materials Chemistry","2000","10","10","2277","","10.1039/b004557h","","","0.7107","MoKα","","","0.0557","","","0.0884","","","","","1.695","1.695","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204005","7.5773","0.0008","13.5538","0.0014","14.2164","0.0013","76.894","0.008","85.153","0.008","74.656","0.009","1370.9","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H11 F4 N5 O S8 -","- C23 F4 N5 O S8 -","- C46 F8 N10 O2 S16 -","2","1","","Ono, Go; Terao, Hiroshi; Higuchi, Saburo; Sugawara, Tadashi; Izuoka, Akira; Mochida, Tomoyuki","One-dimensional double chain composed of carbamoylmethylthio-substituted TTF-based donor in ion radical salt","Journal of Materials Chemistry","2000","10","10","2277","","10.1039/b004557h","","","1.54178","CuKα","","","0.0725","","","0.0765","","","","","1.797","1.797","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204006","5.1393","0.0006","6.363","0.001","11.293","0.001","95.65","0.01","96.874","0.009","92.786","0.01","364.18","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","N2H5CoPO","hydrazinium cobalt phosphate","","- Co2 H6 N2 O8 P2 -","- Co2 H6 N2 O8 P2 -","- Co4 H12 N4 O16 P4 -","2","1","","Ekambaram, Sambandan; Sevov, Slavi C.","Layered cobalt phosphate grafted with hydrazinium ligands: Co2(PO4)(H2PO4)N2H5","Journal of Materials Chemistry","2000","10","11","2522","","10.1039/b004753h","","","0.71073","MoKα","","0.0487","0.0457","","","0.1385","0.1429","","","","","","1.112","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204007","17.3514","0.0006","9.5075","0.0003","9.8065","0.0003","90","","102.682","0.002","90","","1578.3","0.09","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H10 N O6 P1.5 Zn -","- C2 H10 N O6 P1.5 Zn -","- C16 H80 N8 O48 P12 Zn8 -","8","1","","Ayi, Ayi A.; Choudhury, Amitava; Natarajan, Srinivasan; Rao, C. N. R.","Solution-mediated synthesis of a three-dimensional zinc phosphate in the presence of a monoamine","Journal of Materials Chemistry","2000","10","11","2606","","10.1039/b004972g","","","0.71073","MoKα","","0.0345","0.0266","","0.0737","0.0706","","","","1.051","1.087","1.087","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204008","16.778","0.006","14.757","0.004","5.851","0.003","90","","90","","90","","1448.7","1","293","2","180","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C7 H6 N S2 -","- C7 H6 N S2 -","- C56 H48 N8 S16 -","8","1","","McManus, Gordon D.; Rawson, Jeremy M.; Feeder, Neil; Palacio, Fernando; Oliete, Patricia","Structure and magnetic properties of a sulfur‒nitrogen radical, methylbenzodithiazolyl","Journal of Materials Chemistry","2000","10","9","2001","","10.1039/b004992l","","","0.71069","MoKα","","0.0823","0.0523","","0.1315","0.1153","","","","1.029","1.108","1.108","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204009","5.2016","0.0004","13.6024","0.0011","17.2394","0.0013","97.869","0.002","93.302","0.002","91.828","0.002","1205.29","0.16","298","","298","","","","","","","","hydrothermal reaction","6","P -1","-P 1","2","","","","- C6 H26 N2 O18.94 P4 Zn4 -","- C6 H18 N2 O18.93 P4 Zn4 -","- C12 H36 N4 O37.86 P8 Zn8 -","2","1","","Rodgers, Jennifer A.; Harrison, William T. A.","H3N(CH2)6NH3·Zn4(PO4)2(HPO4)2·3H2O: a novel three-dimensional zinc phosphate framework containing 5- and 20-rings","Journal of Materials Chemistry","2000","10","12","2853","","10.1039/b004994h","","","0.71073","MoKα","","","0.0436","","","0.0535","","","","","1.0589","1.0589","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204011","14.6581","0.0001","14.5933","0.0002","21.7985","0.0001","90","","100.32","0.001","90","","4587.48","0.07","120","1","120","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H62 O10 V -","- C50 H62 O10 V -","- C200 H248 O40 V4 -","4","1","","Lin, Raymond; Tsai, Chun-Hsien; Chao, Man-Qian; Lai, Chung K.","Columnar metallomesogens: vanadyl complexes derived from β,δ-triketones","Journal of Materials Chemistry","2001","11","2","359","","10.1039/b005759m","","","0.71073","MoKα","","0.1308","0.0693","","0.1589","0.1377","","","","1.041","1.181","1.181","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204012","7.991","0.002","26.326","0.005","6.588","0.0013","90","","90","","90","","1385.9","0.5","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C15 H19 N3 O2 -","- C15 H19 N3 O2 -","- C60 H76 N12 O8 -","4","1","","Antipin, Mikhail Yu.; Timofeeva, Tatiana V.; Clark, Ronald D.; Nesterov, Vladimir N.; Dolgushin, Fedor M.; Wu, Javier; Leyderman, Alex","Crystal structures and molecular mechanics calculation of nonlinear optical compounds: 2-cyclooctylamino-5-nitropyridine (COANP) and 2-adamantylamino-5-nitropyridine (AANP). New polymorphic modification of AANP and electro-optical effects","Journal of Materials Chemistry","2001","11","2","351","","10.1039/b005822j","","","0.71073","MoKα","","0.3264","0.0659","","0.231","0.0701","","","","0.863","1.36","1.36","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204013","28.31","0.01","6.612","0.002","7.474","0.002","90","","90","","90","","1399","0.8","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C15 H19 N3 O2 -","- C15 H19 N3 O2 -","- C60 H76 N12 O8 -","4","1","","Antipin, Mikhail Yu.; Timofeeva, Tatiana V.; Clark, Ronald D.; Nesterov, Vladimir N.; Dolgushin, Fedor M.; Wu, Javier; Leyderman, Alex","Crystal structures and molecular mechanics calculation of nonlinear optical compounds: 2-cyclooctylamino-5-nitropyridine (COANP) and 2-adamantylamino-5-nitropyridine (AANP). New polymorphic modification of AANP and electro-optical effects","Journal of Materials Chemistry","2001","11","2","351","","10.1039/b005822j","","","0.71073","MoKα","","0.2874","0.0719","","0.4079","0.1218","","","","1.008","1.247","1.247","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204014","26.099","0.005","6.637","0.002","7.555","0.002","90","","90","","90","","1308.7","0.6","167","2","167","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C13 H19 N3 O2 -","- C13 H19 N3 O2 -","- C52 H76 N12 O8 -","4","1","","Antipin, Mikhail Yu.; Timofeeva, Tatiana V.; Clark, Ronald D.; Nesterov, Vladimir N.; Dolgushin, Fedor M.; Wu, Javier; Leyderman, Alex","Crystal structures and molecular mechanics calculation of nonlinear optical compounds: 2-cyclooctylamino-5-nitropyridine (COANP) and 2-adamantylamino-5-nitropyridine (AANP). New polymorphic modification of AANP and electro-optical effects","Journal of Materials Chemistry","2001","11","2","351","","10.1039/b005822j","","","0.71073","MoKα","","0.1519","0.0592","","0.1637","0.1082","","","","1.021","1.205","1.205","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204015","26.285","0.005","6.647","0.001","7.631","0.002","90","","90","","90","","1333.3","0.5","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C13 H19 N3 O2 -","- C13 H19 N3 O2 -","- C52 H76 N12 O8 -","4","1","","Antipin, Mikhail Yu.; Timofeeva, Tatiana V.; Clark, Ronald D.; Nesterov, Vladimir N.; Dolgushin, Fedor M.; Wu, Javier; Leyderman, Alex","Crystal structures and molecular mechanics calculation of nonlinear optical compounds: 2-cyclooctylamino-5-nitropyridine (COANP) and 2-adamantylamino-5-nitropyridine (AANP). New polymorphic modification of AANP and electro-optical effects","Journal of Materials Chemistry","2001","11","2","351","","10.1039/b005822j","","","0.71073","MoKα","","0.1729","0.0736","","0.2592","0.1673","","","","1.068","1.238","1.238","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204016","28.158","0.006","6.584","0.002","7.395","0.001","90","","90","","90","","1371","0.5","163","2","163","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C15 H19 N3 O2 -","- C15 H19 N3 O2 -","- C60 H76 N12 O8 -","4","1","","Antipin, Mikhail Yu.; Timofeeva, Tatiana V.; Clark, Ronald D.; Nesterov, Vladimir N.; Dolgushin, Fedor M.; Wu, Javier; Leyderman, Alex","Crystal structures and molecular mechanics calculation of nonlinear optical compounds: 2-cyclooctylamino-5-nitropyridine (COANP) and 2-adamantylamino-5-nitropyridine (AANP). New polymorphic modification of AANP and electro-optical effects","Journal of Materials Chemistry","2001","11","2","351","","10.1039/b005822j","","","0.71073","MoKα","","0.1084","0.0513","","0.1535","0.1184","","","","1.022","1.073","1.073","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204017","4.9697","0.0006","16.1192","0.0011","10.6277","0.0017","90","","90","","90","","851.36","0.18","150","2","150","2","","","","","","","","4","P b c m","-P 2c 2b","57","","Yttrium silicon nitride oxide","","- N9 O Si5 Y3 -","- N9 O Si5 Y3 -","- N36 O4 Si20 Y12 -","4","0.5","","Liddell, Katharine; Thompson, Derek P.","The crystal structure of Y3Si5N9O and revision of the compositions of some high nitrogen-containing M‒Si‒O‒N (M = Y, La) phases","Journal of Materials Chemistry","2001","11","2","507","","10.1039/b006053o","","","0.6929","MoKα","","0.0331","0.0307","","","0.074","0.0748","","","","","","1.206","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204018","7.877","0.004","14.141","0.002","14.541","0.002","90","","100.35","0.02","90","","1593.3","0.9","293.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H6 S9 -","- C11 H6 S9 -","- C44 H24 S36 -","4","1","","Iwamatsu, Masaki; Kominami, Tsuyoshi; Ueda, Kazumasa; Sugimoto, Toyonari; Tada, Toshiji; Nishimura, Kei-ichiro; Adachi, Tomohiro; Fujita, Hideo; Guo, Fangzhun; Yokogawa, Shoichi; Yoshino, Harukazu; Murata, Keizo; Shiro, Motoo","Crystal structures, and electrical conduction and magnetic properties in CuCl4 salts of dimethylthio- and ethylenedithio-tetrathiafulvalenothioquinone-1,3-dithiolemethides","Journal of Materials Chemistry","2001","11","2","385","","10.1039/b006173p","","","0.7107","MoKα","","","0.0422","","","","0.0976","","","","","","1.09","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204019","9.517","0.004","14.076","0.006","7.789","0.002","94.11","0.03","109.37","0.03","70.69","0.03","928.1","0.7","293.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 Cl2 Cu0.5 S9 -","- C11 H8 Cl2 Cu0.5 S9 -","- C22 H16 Cl4 Cu S18 -","2","1","","Iwamatsu, Masaki; Kominami, Tsuyoshi; Ueda, Kazumasa; Sugimoto, Toyonari; Tada, Toshiji; Nishimura, Kei-ichiro; Adachi, Tomohiro; Fujita, Hideo; Guo, Fangzhun; Yokogawa, Shoichi; Yoshino, Harukazu; Murata, Keizo; Shiro, Motoo","Crystal structures, and electrical conduction and magnetic properties in CuCl4 salts of dimethylthio- and ethylenedithio-tetrathiafulvalenothioquinone-1,3-dithiolemethides","Journal of Materials Chemistry","2001","11","2","385","","10.1039/b006173p","","","0.7107","MoKα","","","0.0709","","","","0.1321","","","","","","1.533","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204020","33.738","0.001","10.6239","0.0003","16.3825","0.0006","90","","95.552","0.001","90","","5844.4","0.3","200.2","","203.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H18 Cl4 Cu S31 -","- C35 H18 Cl4 Cu S31 -","- C140 H72 Cl16 Cu4 S124 -","4","0.5","","Iwamatsu, Masaki; Kominami, Tsuyoshi; Ueda, Kazumasa; Sugimoto, Toyonari; Tada, Toshiji; Nishimura, Kei-ichiro; Adachi, Tomohiro; Fujita, Hideo; Guo, Fangzhun; Yokogawa, Shoichi; Yoshino, Harukazu; Murata, Keizo; Shiro, Motoo","Crystal structures, and electrical conduction and magnetic properties in CuCl4 salts of dimethylthio- and ethylenedithio-tetrathiafulvalenothioquinone-1,3-dithiolemethides","Journal of Materials Chemistry","2001","11","2","385","","10.1039/b006173p","","","0.7107","MoKα","","0.0755","0.0642","","0.1698","","0.151","","","1.0572","","","1.0572","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204021","33.708","0.002","10.574","0.0004","16.401","0.0008","90","","95.609","0.002","90","","5817.8","0.5","120.2","","120.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H18 Cl4 Cu S31 -","- C35 H18 Cl4 Cu S31 -","- C140 H72 Cl16 Cu4 S124 -","4","0.5","","Iwamatsu, Masaki; Kominami, Tsuyoshi; Ueda, Kazumasa; Sugimoto, Toyonari; Tada, Toshiji; Nishimura, Kei-ichiro; Adachi, Tomohiro; Fujita, Hideo; Guo, Fangzhun; Yokogawa, Shoichi; Yoshino, Harukazu; Murata, Keizo; Shiro, Motoo","Crystal structures, and electrical conduction and magnetic properties in CuCl4 salts of dimethylthio- and ethylenedithio-tetrathiafulvalenothioquinone-1,3-dithiolemethides","Journal of Materials Chemistry","2001","11","2","385","","10.1039/b006173p","","","0.7107","MoKα","","0.1174","0.0742","","0.1898","","0.1781","","","1.3071","","","1.3071","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204022","33.851","0.004","10.79","0.01","16.474","0.003","90","","95.38","0.01","90","","5991","6","293.2","","293.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H18 Cl4 Cu S31 -","- C35 H18 Cl4 Cu S31 -","- C140 H72 Cl16 Cu4 S124 -","4","0.5","","Iwamatsu, Masaki; Kominami, Tsuyoshi; Ueda, Kazumasa; Sugimoto, Toyonari; Tada, Toshiji; Nishimura, Kei-ichiro; Adachi, Tomohiro; Fujita, Hideo; Guo, Fangzhun; Yokogawa, Shoichi; Yoshino, Harukazu; Murata, Keizo; Shiro, Motoo","Crystal structures, and electrical conduction and magnetic properties in CuCl4 salts of dimethylthio- and ethylenedithio-tetrathiafulvalenothioquinone-1,3-dithiolemethides","Journal of Materials Chemistry","2001","11","2","385","","10.1039/b006173p","","","0.7107","MoKα","","0.2339","0.0936","","0.2313","","0.2313","","","1.186","","","1.186","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204023","25.495","0.002","9.3495","0.0007","15.859","0.001","89","","89","","90","","3779.1","0.5","198.2","","","","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C34 H28 Mn N8 S8 -","- C34 H28 Mn N8 S8 -","- C136 H112 Mn4 N32 S32 -","4","","","Ken-ichi Sugiura; Kantaro Ushiroda; Mitchell T. Johnson; Joel S. Miller; Yoshiteru Sakata","Ferrimagnetic ordering of a methylthio-substitutedplanar porphyrin based electron transfer salt, octakis(2,3,7,8,12,13,17,18-methylthio)porphyrinatomanganese(III)tetracyanoethanide","J. Mater. Chem.","2000","10","11","2507","2514","10.1039/b006261h","","","0.7107","MoKα","","","0.0561","","","","0.0634","","","","","","1.856","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204024","11.666","0.003","19.62","0.004","9.523","0.002","96.38","0.04","112.72","0.02","89.35","0.03","1996.9","0.9","293","2","293","2","","","","","","","Local laboratory","5","P 1","P 1","1","","","","- C62 H48 N8 O2 S32 -","- C64 H24 N8 S32 -","- C64 H24 N8 S32 -","1","1","","Saito, Gunzi; Sekizaki, Shuichi; Konsha, Akihiko; Yamochi, Hideki; Matsumoto, Kiyoshi; Kusunoki, Masami; Sakaguchi, Ken-ichi","A stable and flexible dianion: 2­dicyanomethylene­1,1,3,4,5,5­hexacyanopentenediide (DHCP2−), and its complex formation","Journal of Materials Chemistry","2001","11","2","364","","10.1039/b006426m","","","0.71069","MoKα","","0.1314","0.0521","","1.2934","0.1301","","","","1.084","1.157","1.157","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204025","15.365","0.007","21.369","0.009","12.961","0.005","99.92","0.03","105.22","0.05","77.02","0.05","3972","3","293","2","293","2","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C62 H48 N8 O2 S32 -","- C64 H32 N8 S32 -","- C128 H64 N16 S64 -","2","1","","Saito, Gunzi; Sekizaki, Shuichi; Konsha, Akihiko; Yamochi, Hideki; Matsumoto, Kiyoshi; Kusunoki, Masami; Sakaguchi, Ken-ichi","A stable and flexible dianion: 2­dicyanomethylene­1,1,3,4,5,5­hexacyanopentenediide (DHCP2−), and its complex formation","Journal of Materials Chemistry","2001","11","2","364","","10.1039/b006426m","","","0.71073","MoKα","","0.1423","0.0603","","1.187","0.1764","","","","1.082","1.195","1.195","","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204026","10.851","0.004","14.492","0.005","19.113","0.007","97.43","0.03","96.38","0.04","102.84","0.03","2875.2","1.9","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H98 O14 Sr Ta2 -","- C42 H98 O14 Sr Ta2 -","- C84 H196 O28 Sr2 Ta4 -","2","1","","Jones, Anthony C.; Davies, Hywel O.; Leedham, Timothy J.; Wright, Peter J.; Crosbie, Michael J.; Steiner, Alexander; Bickley, Jamie F.; O'Brien, Paul; White, Andrew J. P.; Williams, David J.","Crystal structure of a strontium‒tantalum and a magnesium‒niobium heterometal alkoxide: precursors for the MOCVD of ferroelectric oxides","Journal of Materials Chemistry","2001","11","2","544","","10.1039/b006529n","","","0.71073","MoKα","","0.0787","0.0473","","0.113","0.0983","","","","1.027","1.091","1.091","","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204027","8.956","0.003","11.37","0.003","11.63","0.005","95.79","0.04","110.06","0.04","94.27","0.04","1099.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H72 Mg Nb2 O14 -","- C28 H72 Mg Nb2 O14 -","- C28 H72 Mg Nb2 O14 -","1","0.5","","Jones, Anthony C.; Davies, Hywel O.; Leedham, Timothy J.; Wright, Peter J.; Crosbie, Michael J.; Steiner, Alexander; Bickley, Jamie F.; O'Brien, Paul; White, Andrew J. P.; Williams, David J.","Crystal structure of a strontium‒tantalum and a magnesium‒niobium heterometal alkoxide: precursors for the MOCVD of ferroelectric oxides","Journal of Materials Chemistry","2001","11","2","544","","10.1039/b006529n","","","0.71073","MoKα","","0.0557","0.0478","","","0.1313","0.1366","","","","","","1.053","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204030","13.167","0.002","13.969","0.006","14.443","0.003","90","","90","","90","","2656.5","1.3","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O2 S2 -","- C13 H16 N O2 S2 -","- C104 H128 N8 O16 S16 -","8","2","","Blake, Alexander J.; Bruce, Duncan W.; Danks, Jonathan P.; Fallis, Ian A.; Guillon, Daniel; Ross, Steven A.; Richtzenhain, Heiko; Schröder, Martin","Formation of columnar hexagonal mesophases near room temperature from functionalised [9]aneNS2 (1,4-dithia-7-azacyclononane)","Journal of Materials Chemistry","2001","11","4","1011","","10.1039/b006753i","","","0.71073","MoKα","","0.075","0.0574","","0.187","0.1545","","","","1.066","0.951","0.951","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204031","14.49","0.002","8.2086","0.0008","21.994","0.003","90","","96.05","0.012","90","","2601.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 I N2 O3 -","- C26 H21 I N2 O3 -","- C104 H84 I4 N8 O12 -","4","1","","Wang, Xiao-Mei; Zhou, Yu-Fang; Yu, Wen-Tao; Wang, Chun; Fang, Qi; Jiang, Min-Hua; Lei, Hong; Wang, He-Zhou","Two-photon pumped lasing stilbene-type chromophores containing various terminal donor groups: relationship between lasing efficiency and intramolecular charge transfer","Journal of Materials Chemistry","2000","10","12","2698","","10.1039/b006764o","","","0.71073","MoKα","","0.1151","0.0629","","","0.1652","0.1991","","","","","","1.027","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204032","21.438","0.0012","14.9682","0.0011","14.0446","0.001","90","","119.257","0.004","90","","3931.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H27 I N2 O2 -","- C18 H27 I N2 O1.5 -","- C144 H216 I8 N16 O12 -","8","1","","Wang, Xiao-Mei; Zhou, Yu-Fang; Yu, Wen-Tao; Wang, Chun; Fang, Qi; Jiang, Min-Hua; Lei, Hong; Wang, He-Zhou","Two-photon pumped lasing stilbene-type chromophores containing various terminal donor groups: relationship between lasing efficiency and intramolecular charge transfer","Journal of Materials Chemistry","2000","10","12","2698","","10.1039/b006764o","","","0.71073","MoKα","","0.0709","0.0451","","","0.1077","0.124","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204033","4.978","0.003","12","0.01","8.189","0.006","90","","91.97","0.03","90","","488.9","0.6","160","","293","","","","","","","","Aldrich, Lancaster","6","P 1 21/m 1","-P 2yb","11","","Aluminium fluoro ethylenediphosphonate hydrate","","- C2 H4 Al2 F2 O9 P2 -","- C2 H4 Al2 F2 O9 P2 -","- C4 H8 Al4 F4 O18 P4 -","2","0.5","","Harvey, Howard G.; Teat, Simon J.; Attfield, Martin P.","Al2[O3PC2H4PO3](H2O)2F2·H2O: a novel aluminium diphosphonate","Journal of Materials Chemistry","2000","10","12","2632","","10.1039/b006851i","","","0.6942","DaresburySynchrotronradiationsource","","","0.1043","","","","0.107","","","","","","1.0801","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7204034","11.482","0.006","8.33","0.003","35.04","0.01","90","","94.87","0.04","90","","3339","2","50","","50","","","","","","","","","5","A 1 2/a 1","-A 2ya","15","","","","- C12 H8 N1.5 S4 Se4 -","- C12 H8 N1.5 S4 Se4 -","- C96 H64 N12 S32 Se32 -","8","1","","Narymbetov, Bakhyt Zh.; Canadell, Enric; Togonidze, Tamaz; Khasanov, Salavat S.; Zorina, Leokadiya V.; Shibaeva, Rimma P.; Kobayashi, Hayao","First-order phase transition in the organic metal κ-(BETS)2C(CN)3","Journal of Materials Chemistry","2001","11","2","332","","10.1039/b007174i","","","0.71069","MoKα","","","0.082","","","0.092","","","","","2.69","2.69","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204035","11.806","0.004","25.33","0.005","7.337","0.007","89","","104.65","0.04","89","","2122","2","296.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4-bis(1-oxyl-3-oxide-4,4,5,5-tetramethyl-2-imidazolin-2-yl) phenol","","- C20 H27 N4 O5 -","- C20 H26.75 N4 O5 -","- C80 H107 N16 O20 -","4","1","","Hase, Syuichiro; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji","Phenol-substituted nitronyl nitroxide biradicals with a triplet (S = 1) ground state","Journal of Materials Chemistry","2001","11","3","756","","10.1039/b007316o","","","1.5418","CuKα","","","0.0617","","","","0.1917","","","","","","4.844","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204036","20.206","0.004","40.405","0.004","11.888","0.003","90","","90","","90","","9706","3","296.2","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-methyl-2,6-bis(1-oxyl-3-oxide-4,4,5,5-tetramethyl-2-imidazolin-2-yl) phenol","","- C45 H66 N8 O11 -","- C46 H58 N8 O10 -","- C368 H464 N64 O80 -","8","1","","Hase, Syuichiro; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji","Phenol-substituted nitronyl nitroxide biradicals with a triplet (S = 1) ground state","Journal of Materials Chemistry","2001","11","3","756","","10.1039/b007316o","","","1.5418","CuKα","","","0.0587","","","","0.1428","","","","","","1.816","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204037","9.349","0.002","12.953","0.002","9.294","0.002","105.866","0.014","98.569","0.015","107.584","0.015","998.6","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,3,6,8-tetrakis(dimethylamino)pyrene","1,3,6,8-tetrakis(dimethylamino)pyrene","","- C24 H30 N4 -","- C24 H30 N4 -","- C48 H60 N8 -","2","1","","Saito, Gunzi; Hirate, Seiji; Nishimura, Kazukuni; Yamochi, Hideki","Nature of the strong electron donor 1,3,6,8-tetrakis(dimethylamino)pyrene and ionicity of its charge transfer complexes","Journal of Materials Chemistry","2001","11","3","723","","10.1039/b007319i","","","0.71073","MoKα","","0.1445","0.1112","","","0.2986","0.3143","","","","","","1.935","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204038","5.0629","0.0003","11.77","0.002","11.551","0.001","90","","91.039","0.006","90","","688.21","0.14","293","","293","","","","","","","","Solid state synthezis","4","P 1 21/n 1","-P 2yn","14","","Potassium tungsten(V) diphosphate","","- K O8 P2 W -","- K O8 P2 W -","- K4 O32 P8 W4 -","4","1","","Leclaire, A.; Chardon, J.; Raveau, B.","Stabilization of the tungstyl ion configuration: the W(v) diphosphate KWOP2O7","Journal of Materials Chemistry","2001","11","3","846","","10.1039/b007592m","","","0.71073","xray_tube","","","0.0357","","","","0.0356","","","","","","1.811","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204039","8.7318","0.0007","9.5299","0.0008","19.3682","0.0016","90","","99.891","0.001","90","","1587.7","0.2","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H8 I4 N4 Pb -","- C6 H8 I4 N4 Pb -","- C24 H32 I16 N16 Pb4 -","4","0.5","","Tang, Zhongjia; Guan, Jun; Guloy, Arnold M.","Synthesis and crystal structure of new organic-based layered perovskites with 2,2'-biimidazolium cations","Journal of Materials Chemistry","2001","11","2","479","","10.1039/b007639m","","","0.71073","MoKα","","0.0257","0.0243","","","0.0686","0.0702","","","","","","1.169","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204040","8.7238","0.0008","9.5695","0.0009","19.288","0.002","90","","100.18","0.002","90","","1584.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H8 I4 N4 Sn -","- C6 H6 I4 N4 Sn -","- C24 H24 I16 N16 Sn4 -","4","0.5","","Tang, Zhongjia; Guan, Jun; Guloy, Arnold M.","Synthesis and crystal structure of new organic-based layered perovskites with 2,2'-biimidazolium cations","Journal of Materials Chemistry","2001","11","2","479","","10.1039/b007639m","","","0.71073","MoKα","","0.0261","0.0231","","0.0555","0.0543","","","","1.047","1.064","1.064","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204041","6.39","0.0003","9.694","0.0004","7.287","0.0003","90","","90","","90","","451.39","0.03","293","2","293","2","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","","","- Bi Br Cu3 O8 Se2 -","- Bi Br Cu3 O8 Se2 -","- Bi2 Br2 Cu6 O16 Se4 -","2","0.25","","Millet, P.; Bastide, B.; Pashchenko, V.; Gnatchenko, S.; Gapon, V.; Ksari, Y.; Stepanov, A.","Syntheses, crystal structures and magnetic properties of francisite compounds Cu3Bi(SeO3)2O2X (X = Cl, Br and I)","Journal of Materials Chemistry","2001","11","4","1152","","10.1039/b007920k","","","0.5623","","","0.0358","0.0313","","0.082","0.0791","","","","1.083","1.07","1.07","","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204044","7.761","0.006","10.257","0.007","11.119","0.008","73.408","0.012","80.744","0.012","70.24","0.014","796.3","1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C38 H36 N4 O8 -","2","1","","Kay, A. J.; Woolhouse, A. D.; Gainsford, G. J.; Haskell, T. G.; Barnes, T. H.; McKinnie, I. T.; Wyss, C. P.","A simple, novel method for the preparation of polymer-tetherable, zwitterionic merocyanine NLO-chromophores","Journal of Materials Chemistry","2001","11","4","996","","10.1039/b008316j","","","0.71073","MoKα","","0.2327","0.072","","","0.1325","0.1719","","","0.793","","","1.217","","","","has coordinates,has disorder","295878","2024-11-12","07:52:47",""
"7204045","14.437","0.004","13.763","0.004","17.278","0.004","90","","112.45","0.02","90","","3172.9","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","trimethylammonio-tempo iodide","N,N,N-trimethyl-(1-oxyl-2,2,6,6-tetramethylpiperidin-4-yl)ammonium iodide","","- C12 H26 I N2 O -","- C12 H26 I N2 O -","- C96 H208 I8 N16 O8 -","8","2","","Aonuma, Shuji; Casellas, Helene; Faulmann, Christophe; Garreau de Bonneval, Benedicte; Malfant, Isabelle; Cassoux, Patrick; Lacroix, Pascal G.; Hosokoshi, Yuko; Inoue, Katsuya","Structure and properties of novel M(dmit)2 salts with the Me3N+­TEMPO cation radical (Me3N+­TEMPO = N,N,N­trimethyl(1­oxyl­2,2,6,6­tetramethylpiperidin­4­yl)ammonium)","Journal of Materials Chemistry","2001","11","2","337","","10.1039/b008424g","","","0.71069","MoKα","","0.2193","0.0327","","","0.0785","0.1191","","","","","","0.92","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204046","11.4","0.001","10.852","0.001","13.354","0.0017","90","","90","","90","","1652.1","0.3","160","2","160","2","","","","","","","","6","P n m a","-P 2ac 2n","62","trimethylammonio-tempo hexafluorophosphate","N,N,N-trimethyl-(1-oxyl-2,2,6,6-tetramethylpiperidin-4-yl)ammonium hexafluorophosphate","","- C12 H26 F6 N2 O P -","- C12 H26 F6 N2 O P -","- C48 H104 F24 N8 O4 P4 -","4","0.5","","Aonuma, Shuji; Casellas, Helene; Faulmann, Christophe; Garreau de Bonneval, Benedicte; Malfant, Isabelle; Cassoux, Patrick; Lacroix, Pascal G.; Hosokoshi, Yuko; Inoue, Katsuya","Structure and properties of novel M(dmit)2 salts with the Me3N+­TEMPO cation radical (Me3N+­TEMPO = N,N,N­trimethyl(1­oxyl­2,2,6,6­tetramethylpiperidin­4­yl)ammonium)","Journal of Materials Chemistry","2001","11","2","337","","10.1039/b008424g","","","0.71073","MoKα","","0.0519","0.0453","","","0.113","0.117","","","","","","1.072","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204047","14.5213","0.0017","15.982","0.003","18.15","0.005","90","","90","","90","","4212.2","1.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","bis(Me3N-Tempo)Ni(dmit)2","bis[(N,N,N-trimethyl-(1-oxyl-2,2,6,6-tetramethylpiperidin-4-yl)ammonium] bis(2-thioxo-1,3-dithiole-4,5-dithiolato-S4,S5)nickelate(II)","","- C30 H52 N4 Ni O2 S10 -","- C30 H52 N4 Ni O2 S10 -","- C120 H208 N16 Ni4 O8 S40 -","4","0.5","","Aonuma, Shuji; Casellas, Helene; Faulmann, Christophe; Garreau de Bonneval, Benedicte; Malfant, Isabelle; Cassoux, Patrick; Lacroix, Pascal G.; Hosokoshi, Yuko; Inoue, Katsuya","Structure and properties of novel M(dmit)2 salts with the Me3N+­TEMPO cation radical (Me3N+­TEMPO = N,N,N­trimethyl(1­oxyl­2,2,6,6­tetramethylpiperidin­4­yl)ammonium)","Journal of Materials Chemistry","2001","11","2","337","","10.1039/b008424g","","","0.71069","MoKα","","0.0633","0.0271","","","0.0525","0.0609","","","","","","1.023","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204048","14.646","0.003","16.012","0.004","18.126","0.005","90","","90","","90","","4250.8","1.8","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","bis(Me3N-Tempo)Pd(dmit)2","bis[(N,N,N-trimethyl-(1-oxyl-2,2,6,6-tetramethylpiperidin-4-yl)ammonium] bis(2-thioxo-1,3-dithiole-4,5-dithiolato-S4,S5)palladate(II)","","- C30 H52 N4 O2 Pd S10 -","- C30 H52 N4 O2 Pd S10 -","- C120 H208 N16 O8 Pd4 S40 -","4","0.5","","Aonuma, Shuji; Casellas, Helene; Faulmann, Christophe; Garreau de Bonneval, Benedicte; Malfant, Isabelle; Cassoux, Patrick; Lacroix, Pascal G.; Hosokoshi, Yuko; Inoue, Katsuya","Structure and properties of novel M(dmit)2 salts with the Me3N+­TEMPO cation radical (Me3N+­TEMPO = N,N,N­trimethyl(1­oxyl­2,2,6,6­tetramethylpiperidin­4­yl)ammonium)","Journal of Materials Chemistry","2001","11","2","337","","10.1039/b008424g","","","0.71073","MoKα","","0.1712","0.0401","","","0.1048","0.1445","","","","","","0.968","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204049","8.3716","0.0011","11.998","0.0019","28.592","0.004","90","","91.251","0.016","90","","2871.2","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(Me3N-Tempo)Ni(dmit)2","[(N,N,N-trimethyl-(1-oxyl-2,2,6,6-tetramethylpiperidin-4-yl)ammonium] bis(2-thioxo-1,3-dithiole-4,5-dithiolato-S4,S5)nickelate(III)","","- C18 H26 N2 Ni O S10 -","- C18 H26 N2 Ni O S10 -","- C72 H104 N8 Ni4 O4 S40 -","4","1","","Aonuma, Shuji; Casellas, Helene; Faulmann, Christophe; Garreau de Bonneval, Benedicte; Malfant, Isabelle; Cassoux, Patrick; Lacroix, Pascal G.; Hosokoshi, Yuko; Inoue, Katsuya","Structure and properties of novel M(dmit)2 salts with the Me3N+­TEMPO cation radical (Me3N+­TEMPO = N,N,N­trimethyl(1­oxyl­2,2,6,6­tetramethylpiperidin­4­yl)ammonium)","Journal of Materials Chemistry","2001","11","2","337","","10.1039/b008424g","","","0.71073","MoKα","","0.3304","0.0715","","","0.1551","0.2509","","","","","","0.716","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204050","13.8327","0.0004","13.8327","0.0004","13.8327","0.0004","90","","90","","90","","2646.8","0.13","293","2","293","2","","","","","","","","5","P n -3 :2","-P 2ab 2bc 3","201","","","","- Cl15 Lu3 Nb6 O6 Pb -","- Cl15 Lu3 Nb6 O6 Pb0.956 -","- Cl60 Lu12 Nb24 O24 Pb3.824 -","4","0.166667","","Gulo, Fakhili; Roisnel, Thierry; Perrin, Christiane","The crystal structure of PbLu3Nb6Cl15O6, a new oxychloride based on discrete Nb6Cl12O6 units","Journal of Materials Chemistry","2001","11","4","1237","","10.1039/b008609f","","","0.71073","MoKα","","0.0383","0.0316","","","0.0699","0.0726","","","","","","1.097","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204051","9.2233","0.0005","11.5932","0.0006","17.8088","0.0009","93.863","0.001","94.543","0.001","103.071","0.001","1841.94","0.17","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(ethylenedithio)tetrathiafulvalenium 1-pentafluorothio-1,2,2-trifluoro-ethylsulfonate (2:1)","","- C22 H17 F8 O3 S18 -","- C21.996 H17 F7.988 O2.996 S18 -","- C43.992 H34 F15.976 O5.992 S36 -","2","1","","John A. Schlueter; Brian H. Ward; Urs Geiser; Hau H. Wang; Aravinda M. Kini; James Parakka; Emilio Morales; H.-J. Koo; M.-H. Whangbo; R. W. Winter; J. Mohtasham; Gary L. Gard","Crystal structure, physical properties and electronic structure of a new organic conductor β″-(BEDT-TTF)2SF5CHFCF2SO3","J. Mater. Chem.","2001","11","8","2008","2013","10.1039/b008735l","","","0.71073","MoKα","","0.1126","0.079","","","0.171","0.1922","","","","","","1.055","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204052","9.2462","0.0004","11.361","0.0005","17.7145","0.0008","94.121","0.001","94.914","0.001","103.139","0.001","1797.45","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Bis(ethylenedithio)tetrathiafulvalenium 1-pentafluorothio-1,2,2-trifluoro-ethylsulfonate (2:1)","","- C22 H17 F8 O3 S18 -","- C22.006 H17 F8.018 O3.006 S18 -","- C44.012 H34 F16.036 O6.012 S36 -","2","1","","John A. Schlueter; Brian H. Ward; Urs Geiser; Hau H. Wang; Aravinda M. Kini; James Parakka; Emilio Morales; H.-J. Koo; M.-H. Whangbo; R. W. Winter; J. Mohtasham; Gary L. Gard","Crystal structure, physical properties and electronic structure of a new organic conductor β″-(BEDT-TTF)2SF5CHFCF2SO3","J. Mater. Chem.","2001","11","8","2008","2013","10.1039/b008735l","","","0.71073","MoKα","","0.0656","0.0527","","","0.1209","0.1301","","","","","","1.047","","","","has coordinates,has disorder","180371","2020-10-21","18:00:00",""
"7204053","15.6","0.01","16.323","0.01","6.96","0.01","103.94","0.08","103.98","0.08","95.77","0.06","1645","3","288.2","","","","","","","","","","","8","P -1","-P 1","2","","","","- C27 H12 Cl0.5 F6 N4 O2 P S8 -","- C27 H14 Cl0.5 F6 N4 O2 P S8 -","- C54 H28 Cl F12 N8 O4 P2 S16 -","2","1","","Ise, Toshihiro; Mori, Takehiko; Takahashi, Kazuko","Preparation, crystal structures and electrical properties of PF6 and AsF6 salts of a novel furopyrazine-extended donor (BDTFP) with a two-leg ladder type orbital overlapping mode","Journal of Materials Chemistry","2001","11","2","264","","10.1039/b008758k","","","0.7107","MoKα","","","0.068","","","","0.0792","","","","","","0.296","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204054","15.66","0.02","16.531","0.01","6.98","0.003","104.21","0.02","102.92","0.03","96.42","0.05","1681","3","288.2","","","","","","","","","","","8","P -1","-P 1","2","","","","- C27 H12 As Cl F6 N4 O2 S8 -","- C27 H14 As Cl0.5 F6 N4 O2 S8 -","- C54 H28 As2 Cl F12 N8 O4 S16 -","2","1","","Ise, Toshihiro; Mori, Takehiko; Takahashi, Kazuko","Preparation, crystal structures and electrical properties of PF6 and AsF6 salts of a novel furopyrazine-extended donor (BDTFP) with a two-leg ladder type orbital overlapping mode","Journal of Materials Chemistry","2001","11","2","264","","10.1039/b008758k","","","0.7107","MoKα","","","0.0782","","","","0.0884","","","","","","0.241","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204055","14.577","0.002","22.601","0.004","22.184","0.003","90","","105.52","0.03","90","","7042","2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","trans-4-[2-(3,4,5-trimethoxyphenyl)vinyl]benzoic acid / tris(imidazoline), 3:1 complex / ethanol hydrate","","- C70 H83 N6 O19.5 -","- C70 H75 N6 O19.5 -","- C280 H300 N24 O78 -","4","1","","Osterod, Frank; Peters, Lars; Kraft, Arno; Sano, Takeshi; Morrison, John J.; Feeder, Neil; Holmes, Andrew B.","Luminescent supramolecular assemblies based on hydrogen­bonded complexes of stilbenecarboxylic acids and dithieno[3,2­b:2',3'­d]thiophene­2­carboxylic acids with a tris(imidazoline) base","Journal of Materials Chemistry","2001","11","6","1625","","10.1039/b009406o","","","0.6919","Synchrotron","","0.2761","0.1586","","","0.3645","0.4216","","","","","","1.14","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7204056","9.8977","0.0007","32.031","0.002","16.209","0.001","90","","107.72","0.01","90","","4895","0.6","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dithieno[3,2-b;2',3'-d]thiophene-2-carboxylic acid / tris(imidazoline), 3:1 complex / ethanol/chloroform solvate","","- C45 H37 Cl3 N6 O7 S9 -","- C45 H37 Cl3 N6 O7 S9 -","- C180 H148 Cl12 N24 O28 S36 -","4","1","","Osterod, Frank; Peters, Lars; Kraft, Arno; Sano, Takeshi; Morrison, John J.; Feeder, Neil; Holmes, Andrew B.","Luminescent supramolecular assemblies based on hydrogen­bonded complexes of stilbenecarboxylic acids and dithieno[3,2­b:2',3'­d]thiophene­2­carboxylic acids with a tris(imidazoline) base","Journal of Materials Chemistry","2001","11","6","1625","","10.1039/b009406o","","","0.6883","Synchrotron","","0.0905","0.0687","","","0.1764","0.1862","","","","","","0.969","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204058","12.4117","0.0019","28.47","0.004","12.4864","0.0019","90","","98.596","0.003","90","","4362.6","1.1","193","2","193","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C39 H34 F12 N6 O P2 Ru S4 -","- C39 H34 F12 N6 O P2 Ru S4 -","- C156 H136 F48 N24 O4 P8 Ru4 S16 -","4","0.5","","MacLean, Brian J.; Pickup, Peter G.","Bithiophene‒bithiazole copolymers and their metal complexes","Journal of Materials Chemistry","2001","11","5","1357","","10.1039/b009568k","","","0.71073","MoKα","","0.1037","0.0785","","","0.212","0.2301","","","","","","1.023","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204059","7.891","0.006","16.406","0.005","6.629","0.003","96.09","0.03","100.43","0.05","87.1","0.05","838.8","0.8","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","(BPT-TSF)2AsF6","","","- C24 H24 As F6 S4 Se8 -","- C25.8 As F6 S3.32 Se8 -","- C25.8 As F6 S3.32 Se8 -","1","0.5","","Jigami, Tetsuya; Kodani, Mie; Murakami, Satoshi; Takimiya, Kazuo; Aso, Yoshio; Otsubo, Tetsuo","Synthesis and properties of novel heterocycle-fused TTF-type electron donors: bis(propylenethio)tetrathiafulvalene (BPT-TTF), bis(propyleneseleno)tetrathiafulvalene (BPS-TTF), and their tetraselenafulvalene analogues (BPT-TSF and BPS-TSF)","Journal of Materials Chemistry","2001","11","4","1026","","10.1039/b009700o","","","0.7107","MoKα","","0.0326","0.0326","","","0.034","0.034","","","","","","3.303","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204060","11.731","0.004","35.41","0.02","8.609","0.003","90.03","0.04","89.99","0.03","90.06","0.04","3576","3","296.2","","296.2","","","","","","","","","6","P n m a","-P 2ac 2n","62","(BPT-TSF)2-FeCl4","","","- C24 H24 Cl4 Fe S4 Se8 -","- C26.34 Cl4 Fe S3.14 Se8 -","- C105.36 Cl16 Fe4 S12.56 Se32 -","4","0.5","","Jigami, Tetsuya; Kodani, Mie; Murakami, Satoshi; Takimiya, Kazuo; Aso, Yoshio; Otsubo, Tetsuo","Synthesis and properties of novel heterocycle-fused TTF-type electron donors: bis(propylenethio)tetrathiafulvalene (BPT-TTF), bis(propyleneseleno)tetrathiafulvalene (BPS-TTF), and their tetraselenafulvalene analogues (BPT-TSF and BPS-TSF)","Journal of Materials Chemistry","2001","11","4","1026","","10.1039/b009700o","","","0.7107","MoKα","","0.0671","0.0671","","","0.055","0.055","","","","","","4.389","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204061","10.793","0.004","15.769","0.005","8.312","0.003","93.85","0.03","109.43","0.02","88.04","0.03","1331","0.8","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","(BPS-TSF)2-SbF6","","","- C36 H36 As2 F12 Se18 -","- C38.84 As2 F12 Se17.5 -","- C38.84 As2 F12 Se17.5 -","1","0.5","","Jigami, Tetsuya; Kodani, Mie; Murakami, Satoshi; Takimiya, Kazuo; Aso, Yoshio; Otsubo, Tetsuo","Synthesis and properties of novel heterocycle-fused TTF-type electron donors: bis(propylenethio)tetrathiafulvalene (BPT-TTF), bis(propyleneseleno)tetrathiafulvalene (BPS-TTF), and their tetraselenafulvalene analogues (BPT-TSF and BPS-TSF)","Journal of Materials Chemistry","2001","11","4","1026","","10.1039/b009700o","","","0.7107","MoKα","","0.0421","0.0421","","","0.0455","0.0455","","","","","","1.689","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204062","10.6231","0.0012","11.3337","0.001","12.491","0.003","73.503","0.009","89.978","0.01","79.759","0.008","1417","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H30 N2 -","- C38 H30 N2 -","- C76 H60 N4 -","2","1","","XiaoMei Wang; Dong Wang; GuangYong Zhou; WenTao Yu; YuFang Zhou; Qi Fang; MinHua Jiang","Symmetric and asymmetric charge transfer process of two-photon absorbing chromophores: bis-donor substituted stilbenes, and substituted styrylquinolinium and styrylpyridinium derivatives","J. Mater. Chem.","2001","11","6","1600","1605","10.1039/b009769l","","","0.71073","MoKα","","0.1408","0.0562","","","0.1245","0.1586","","","","","","0.966","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204063","18.6842","0.0012","18.6842","0.0012","9.408","0.0008","90","","90","","90","","3284.3","0.4","293","2","293","2","","","","","","","","8","P 4/n :2","-P 4a","85","nicoapo-sta7","","","- C3.8 H9.9 Al2.5 Co0.5 N1.1 Ni0.25 O12.5 P3 -","- C3.8 Al2.5 Co0.5 N1.1 Ni0.25 O12.5 P3 -","- C30.4 Al20 Co4 N8.8 Ni2 O100 P24 -","8","1","","Garcia, Raquel; Philp, Eilidh F.; Slawin, Alexandra M. Z.; Wright, Paul A.; Cox, Paul A.","Nickel complexed within an azamacrocycle as a structure directing agent in the crystallization of the framework metalloaluminophosphates STA-6 and STA-7","Journal of Materials Chemistry","2001","11","5","1421","","10.1039/b009813m","","","0.71073","MoKα","","0.1563","0.0781","","0.2645","0.1917","","","","1.079","1.081","1.081","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204064","8.8835","0.0019","6.8743","0.0015","9.5526","0.0017","90","","93.82","0.005","90","","582.1","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H7 Al N O5 P -","- C2 H7 Al N O5 P -","- C8 H28 Al4 N4 O20 P4 -","4","1","","Wang, Kaixue; Yu, Jihong; Miao, Peng; Song, Yu; Li, Jiyang; Shi, Zhan; Xu, Ruren","A new layered aluminophosphate [C4H12N2][Al2P2O8(OH)2] templated by piperazine","Journal of Materials Chemistry","2001","11","7","1898","","10.1039/b010206g","","","0.71073","MoKα","","0.0384","0.0277","","","0.0689","0.0729","","","","","","1.096","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204066","14.226","0.002","14.226","0.002","6.414","0.001","90","","90","","90","","1298.1","0.3","288.2","","288.2","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C64 H32 As Co0.9 F6 N16 Ni1.1 -","- C32 H16 As0.12 Co0.12 F3.84 N8 Ni0.14 -","- C32 H16 As0.12 Co0.12 F3.84 N8 Ni0.14 -","1","0.0625","","Ding, Yuqin; Simonyan, Mkhital; Yonehara, Yukako; Uruichi, Mikio; Yakushi, Kyuya","Preparation and characterization of phthalocyanine-based organic alloy CoxNi1 − xPc(AsF6)0.5 (0 ≤ x ≤ 1)","Journal of Materials Chemistry","2001","11","5","1469","","10.1039/b100043h","","","0.7107","MoKα","","","0.0701","","","0.0727","","","","","2.138","2.138","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204067","14.033","0.004","28.54","0.01","6.435","0.002","90","","90","","90","","2577.2","1.4","288.2","","288.2","","","","","","","","","7","P n c 2","P 2 -2bc","30","","","","- C64 H32 As Co0.5 F6 N16 Ni1.5 -","- C64 H32 As0.5 Co0.5 F6 N16 Ni1.5 -","- C128 H64 As Co F12 N32 Ni3 -","2","0.5","","Ding, Yuqin; Simonyan, Mkhital; Yonehara, Yukako; Uruichi, Mikio; Yakushi, Kyuya","Preparation and characterization of phthalocyanine-based organic alloy CoxNi1 − xPc(AsF6)0.5 (0 ≤ x ≤ 1)","Journal of Materials Chemistry","2001","11","5","1469","","10.1039/b100043h","","","0.7107","MoKα","","","0.0677","","","0.0881","","","","","2.709","2.709","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204068","6.7026","0.0013","7.4586","0.0015","15.789","0.003","95.6","0.03","98.47","0.03","104.2","0.03","749.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTFBr2)2 IBr2","Bis(3,4-dibromo-3',4'-ethylenedithiotetrathiafulvalene) dibromoiodide","","- C16 H8 Br6 I S12 -","- C16 H8 Br6 I S12 -","- C16 H8 Br6 I S12 -","1","0.5","","Benoît Domercq; Thomas Devic; Marc Fourmigué; Pascale Auban-Senzier; Enric Canadell","HalHal interactions in a series of three isostructural salts of halogenated tetrathiafulvalenes. Contribution of the halogen atoms to the HOMO‒HOMO overlap interactions","J. Mater. Chem.","2001","11","6","1570","1575","10.1039/b100103p","","","0.71073","MoKα","","0.0372","0.025","","","0.0504","0.0528","","","","","","0.904","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204069","6.7796","0.0014","7.5112","0.0015","16.117","0.003","95.61","0.03","99.74","0.03","103.1","0.03","779.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","2(EDT-TTF-BR2), I3","Bis(3,4-dibromo-3',4'-ethylenedithiotetrathiafulvalene) triiodide","","- C8 H4 Br2 I1.5 S6 -","- C8 H4 Br2 I1.5 S6 -","- C16 H8 Br4 I3 S12 -","2","1","","Benoît Domercq; Thomas Devic; Marc Fourmigué; Pascale Auban-Senzier; Enric Canadell","HalHal interactions in a series of three isostructural salts of halogenated tetrathiafulvalenes. Contribution of the halogen atoms to the HOMO‒HOMO overlap interactions","J. Mater. Chem.","2001","11","6","1570","1575","10.1039/b100103p","","","0.71073","MoKα","","0.0384","0.0256","","","0.0504","0.0527","","","","","","0.845","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204070","7.0316","0.0014","7.6515","0.0015","16.138","0.003","95.2","0.03","98.54","0.03","103.49","0.03","827.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2(EDT-TTF-I2), I3","Bis(3,4-diiodo-3',4'-ethylenedithiotetrathiafulvalene), triiodide","","- C16 H8 I7 S12 -","- C16 H8 I7 S12 -","- C16 H8 I7 S12 -","1","0.5","","Benoît Domercq; Thomas Devic; Marc Fourmigué; Pascale Auban-Senzier; Enric Canadell","HalHal interactions in a series of three isostructural salts of halogenated tetrathiafulvalenes. Contribution of the halogen atoms to the HOMO‒HOMO overlap interactions","J. Mater. Chem.","2001","11","6","1570","1575","10.1039/b100103p","","","0.71073","MoKα","","0.0529","0.0456","","","0.1172","0.1207","","","","","","1.104","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204071","8.2993","0.0017","9.3651","0.0019","9.707","0.0019","104.7","0.02","104.99","0.02","96.58","0.02","691.7","0.3","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H48 N4 O8 Ti2 -","- C20 H48 N4 O8 Ti2 -","- C20 H48 N4 O8 Ti2 -","1","0.5","","Jones, Anthony C.; Williams, Paul A.; Bickley, Jamie F.; Steiner, Alexander; Davies, Hywel O.; Leedham, Timothy J.; Awaluddin, Amir; Pemble, Martyn E.; Critchlow, Gary W.","Synthesis and crystal structures of two new titanium alkoxy‒diolate complexes. Potential precursors for oxide ceramics","Journal of Materials Chemistry","2001","11","5","1428","","10.1039/b100411p","","","0.71073","MoKα","","0.0516","0.0355","","","0.0799","0.0833","","","","","","0.913","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204072","9.3358","0.0014","10.0168","0.0016","11.4403","0.0018","110.358","0.017","107.365","0.018","99.353","0.018","913.9","0.3","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H64 N4 O8 Ti2 -","- C28 H64 N4 O8 Ti2 -","- C28 H64 N4 O8 Ti2 -","1","0.5","","Jones, Anthony C.; Williams, Paul A.; Bickley, Jamie F.; Steiner, Alexander; Davies, Hywel O.; Leedham, Timothy J.; Awaluddin, Amir; Pemble, Martyn E.; Critchlow, Gary W.","Synthesis and crystal structures of two new titanium alkoxy‒diolate complexes. Potential precursors for oxide ceramics","Journal of Materials Chemistry","2001","11","5","1428","","10.1039/b100411p","","","0.71073","MoKα","","0.0377","0.0299","","","0.0794","0.0823","","","","","","1.014","","","","has coordinates","180371","2020-10-21","18:00:00",""
"7204073","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 H14 F2 Ga6 N2 O25 P6 -","- C10 H12 F2 Ga6 N2 O25 P6 -","- C20 H24 F4 Ga12 N4 O50 P12 -","2","1","","Wragg, David S.; Slawin, Alexandra M. Z.; Morris, Russell E.","The synthesis of gallium phosphate frameworks with and without fluoride ions present: attempts to direct the synthesis of double four-ring containing materials","Journal of Materials Chemistry","2001","11","7","1850","","10.1039/b100471i","","","0.6849","","","0.0481","0.0454","","","0.1272","0.1288","","","","","","1.207","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204074","9.265","0.005","9.397","0.008","9.238","0.005","94.36","0.06","90.64","0.05","103.67","0.05","778.9","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H14 F2 Ga6 N2 O25 P6 -","- C10 H12 F2 Ga6 N2 O25 P6 -","- C10 H12 F2 Ga6 N2 O25 P6 -","1","0.5","","Wragg, David S.; Slawin, Alexandra M. Z.; Morris, Russell E.","The synthesis of gallium phosphate frameworks with and without fluoride ions present: attempts to direct the synthesis of double four-ring containing materials","Journal of Materials Chemistry","2001","11","7","1850","","10.1039/b100471i","","","0.71073","MoKα","","0.0313","0.0276","","","0.0788","0.0809","","","","","","1.02","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204075","12.157","0.003","14.202","0.003","13.065","0.005","90","","91.848","0.002","90","","2254.5","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H13 F2 Ga4 N2 O17 P4 -","- C10 H14 F2 Ga4 N2 O17 P4 -","- C40 H56 F8 Ga16 N8 O68 P16 -","4","1","","Wragg, David S.; Slawin, Alexandra M. Z.; Morris, Russell E.","The synthesis of gallium phosphate frameworks with and without fluoride ions present: attempts to direct the synthesis of double four-ring containing materials","Journal of Materials Chemistry","2001","11","7","1850","","10.1039/b100471i","","","0.71073","MoKα","","0.0776","0.0485","","","0.1437","0.1593","","","","","","1.123","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204076","13.016","0.003","13.016","0.003","7.356","0.004","90","","90","","90","","1246.2","0.8","293","2","293","2","","","","","","","","6","I -4 2 m","I -4 2","121","","","","- C10 H20 Ga4 N2 O21 P4 -","- C12 H12 Ga4 O21 P4 -","- C24 H24 Ga8 O42 P8 -","2","0.125","","Wragg, David S.; Slawin, Alexandra M. Z.; Morris, Russell E.","The synthesis of gallium phosphate frameworks with and without fluoride ions present: attempts to direct the synthesis of double four-ring containing materials","Journal of Materials Chemistry","2001","11","7","1850","","10.1039/b100471i","","","1.54178","CuKα","","0.079","0.0704","","0.1953","0.1838","","","","1.089","1.111","1.111","","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7204077","13.9001","0.0005","7.3319","0.0002","16.3165","0.0005","90","","90","","90","","1662.88","0.09","295","","","","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C40.5 H26 Fe N11.5 -","- C40.5 H16 Fe N11.5 -","- C81 H32 Fe2 N23 -","2","0.25","","Matsuda, Masaki; Naito, Toshio; Inabe, Tamotsu; Hanasaki, Noriaki; Tajima, Hiroyuki","Structure and electrical and magnetic properties of (PTMA)x[M(Pc)(CN)2]·y(solvent) (PTMA = phenyltrimethylammonium and [M(Pc)(CN)2] = dicyano(phthalocyaninato)Miii with M = Co and Fe). Partial oxidation by partial solvent occupation of the cationic site","Journal of Materials Chemistry","2001","11","10","2493","","10.1039/b100623l","","","0.7107","MoKα","","","0.0505","","","","0.0577","","","","","","3.182","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204078","13.8706","0.0006","7.3498","0.0003","16.2958","0.0007","90","","90","","90","","1661.29","0.12","295","","","","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C40.5 H26 Co N11.5 -","- C40.5 H16 Co N11.5 -","- C81 H32 Co2 N23 -","2","0.25","","Matsuda, Masaki; Naito, Toshio; Inabe, Tamotsu; Hanasaki, Noriaki; Tajima, Hiroyuki","Structure and electrical and magnetic properties of (PTMA)x[M(Pc)(CN)2]·y(solvent) (PTMA = phenyltrimethylammonium and [M(Pc)(CN)2] = dicyano(phthalocyaninato)Miii with M = Co and Fe). Partial oxidation by partial solvent occupation of the cationic site","Journal of Materials Chemistry","2001","11","10","2493","","10.1039/b100623l","","","0.7107","MoKα","","","0.0467","","","","0.046","","","","","","2.387","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204079","13.85","0.001","7.2494","0.0004","16.155","0.001","90","","90","","90","","1622.03","0.18","123","","","","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C40.5 H26 Fe N11.5 -","- C41.5 H16 Fe N11.5 -","- C83 H32 Fe2 N23 -","2","0.25","","Matsuda, Masaki; Naito, Toshio; Inabe, Tamotsu; Hanasaki, Noriaki; Tajima, Hiroyuki","Structure and electrical and magnetic properties of (PTMA)x[M(Pc)(CN)2]·y(solvent) (PTMA = phenyltrimethylammonium and [M(Pc)(CN)2] = dicyano(phthalocyaninato)Miii with M = Co and Fe). Partial oxidation by partial solvent occupation of the cationic site","Journal of Materials Chemistry","2001","11","10","2493","","10.1039/b100623l","","","0.7107","MoKα","","","0.0512","","","","0.0534","","","","","","2.943","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204080","13.6682","0.0005","7.3102","0.0002","16.3705","0.0007","90","","90","","90","","1635.7","0.1","113","","","","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C41.5 H30 Co N10.5 O -","- C40.5 H16 Co N11.5 O -","- C81 H32 Co2 N23 O2 -","2","0.25","","Matsuda, Masaki; Naito, Toshio; Inabe, Tamotsu; Hanasaki, Noriaki; Tajima, Hiroyuki","Structure and electrical and magnetic properties of (PTMA)x[M(Pc)(CN)2]·y(solvent) (PTMA = phenyltrimethylammonium and [M(Pc)(CN)2] = dicyano(phthalocyaninato)Miii with M = Co and Fe). Partial oxidation by partial solvent occupation of the cationic site","Journal of Materials Chemistry","2001","11","10","2493","","10.1039/b100623l","","","0.7107","MoKα","","","0.0432","","","","0.053","","","","","","1.343","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204088","4.716","0.002","16.583","0.002","6.709","0.002","90","","104.84","0.02","90","","507.2","0.3","223.7","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 N4 O2 -","- C10 H8 N4 O2 -","- C20 H16 N8 O4 -","2","0.5","","Sugiura, Ken-ichi; Mikami, Shinji; Johnson, Mitchell T.; Raebiger, James W.; Miller, Joel S.; Iwasaki, Kentaro; Okada, Yuko; Hino, Shojun; Sakata, Yoshiteru","Ferrimagnetic ordering of one-dimensional N,N'-dicyanoquinone diimine (DCNQI) electron transfer salts with porphyrinatomanganese(II)","Journal of Materials Chemistry","2001","11","9","2152","","10.1039/b100936m","","","0.7107","MoKα","","","0.0529","","","","0.0782","","","","","","1.272","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204089","12.988","0.005","20.02","0.006","15.548","0.005","90","","104.6","0.03","90","","3912","2","198.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C90 H80 Cl4 Mn N8 -","- C90 H78 Cl4 Mn N8 -","- C180 H156 Cl8 Mn2 N16 -","2","0.5","","Sugiura, Ken-ichi; Mikami, Shinji; Johnson, Mitchell T.; Raebiger, James W.; Miller, Joel S.; Iwasaki, Kentaro; Okada, Yuko; Hino, Shojun; Sakata, Yoshiteru","Ferrimagnetic ordering of one-dimensional N,N'-dicyanoquinone diimine (DCNQI) electron transfer salts with porphyrinatomanganese(II)","Journal of Materials Chemistry","2001","11","9","2152","","10.1039/b100936m","","","0.7107","MoKα","","","0.1095","","","","0.1653","","","","","","1.942","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204090","12.795","0.002","14.082","0.002","12.042","0.002","104.33","0.01","95.09","0.02","111.35","0.01","1919.1","0.6","223.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C90 H90 Mn N8 O2 -","- C90 H90 Mn N8 O2 -","- C90 H90 Mn N8 O2 -","1","0.5","","Sugiura, Ken-ichi; Mikami, Shinji; Johnson, Mitchell T.; Raebiger, James W.; Miller, Joel S.; Iwasaki, Kentaro; Okada, Yuko; Hino, Shojun; Sakata, Yoshiteru","Ferrimagnetic ordering of one-dimensional N,N'-dicyanoquinone diimine (DCNQI) electron transfer salts with porphyrinatomanganese(II)","Journal of Materials Chemistry","2001","11","9","2152","","10.1039/b100936m","","","0.7107","MoKα","","","0.0602","","","","0.085","","","","","","1.657","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204091","10.2732","0.0002","19.9494","0.0003","35.0304","0.0006","90","","92.969","0.001","90","","7169.6","0.2","120","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","ET4NH4Fe(OX)3C6H5NO2","","","- C26 H20.5 Fe0.5 N O7 S16 -","- C26 H20.5 Fe0.5 N O7 S16 -","- C208 H164 Fe4 N8 O56 S128 -","8","1","","Rashid, Samina; Turner, Scott S.; Day, Peter; Howard, Judith A. K.; Guionneau, Philippe; McInnes, Eric J. L.; Mabbs, Frank E.; Clark, Robin J. H.; Firth, Steven; Biggs, Tim","New superconducting charge-transfer salts (BEDT-TTF)4[A·M(C2O4)3]·C6H5NO2 (A = H3O or NH4, M = Cr or Fe, BEDT-TTF = bis(ethylenedithio)tetrathiafulvalene)","Journal of Materials Chemistry","2001","11","9","2095","","10.1039/b101134k","","","0.71073","MoKα","","0.0527","0.0378","","0.08","0.0724","","","","1.13","1.141","1.141","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204092","10.2834","0.0001","19.9172","0.0001","34.9399","0.0002","90","","93.299","0.001","90","","7144.41","0.09","120","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H20.5 Cr0.5 N O7 S16 -","- C26 H20.5 Cr0.5 N O7 S16 -","- C208 H164 Cr4 N8 O56 S128 -","8","1","","Rashid, Samina; Turner, Scott S.; Day, Peter; Howard, Judith A. K.; Guionneau, Philippe; McInnes, Eric J. L.; Mabbs, Frank E.; Clark, Robin J. H.; Firth, Steven; Biggs, Tim","New superconducting charge-transfer salts (BEDT-TTF)4[A·M(C2O4)3]·C6H5NO2 (A = H3O or NH4, M = Cr or Fe, BEDT-TTF = bis(ethylenedithio)tetrathiafulvalene)","Journal of Materials Chemistry","2001","11","9","2095","","10.1039/b101134k","","","0.71073","MoKα","","0.096","0.047","","0.1109","0.0902","","","","1.028","1.065","1.065","","","","","has coordinates","189056","2020-10-21","18:00:00",""
"7204093","10.3039","0.0002","20.0908","0.0003","35.2508","0.0004","90","","92.701","0.001","90","","7289.3","0.2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H20.5 Cr0.5 N O7 S16 -","- C26 H20.5 Cr0.5 N O7 S16 -","- C208 H164 Cr4 N8 O56 S128 -","8","1","","Rashid, Samina; Turner, Scott S.; Day, Peter; Howard, Judith A. K.; Guionneau, Philippe; McInnes, Eric J. L.; Mabbs, Frank E.; Clark, Robin J. H.; Firth, Steven; Biggs, Tim","New superconducting charge-transfer salts (BEDT-TTF)4[A·M(C2O4)3]·C6H5NO2 (A = H3O or NH4, M = Cr or Fe, BEDT-TTF = bis(ethylenedithio)tetrathiafulvalene)","Journal of Materials Chemistry","2001","11","9","2095","","10.1039/b101134k","","","0.71073","MoKα","","0.1637","0.0646","","","0.1265","0.1719","","","","","","1.061","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204102","7.694","0.001","9.21","0.001","10.764","0.002","108.598","0.003","92.3","0.003","109.814","0.003","670.66","0.17","288.2","","288.2","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H38 Ni3 O21 -","- C18 H20 Ni2.5 O21 -","- C18 H20 Ni2.5 O21 -","1","0.5","","Kumagai, Hitoshi; Akita-Tanaka, Motoko; Inoue, Katsuya; Kurmoo, Mohamedally","Hydrothermal synthesis and characterization of a new 3D-network containing the versatile cis,cis-cyclohexane-1,3,5-tricarboxylate","Journal of Materials Chemistry","2001","11","9","2146","","10.1039/b101531l","","","0.7107","MoKα","","0.0527","0.0483","","0.0611","0.0605","","","","4.113","4.378","4.378","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204103","7.799","0.002","9.212","0.002","10.784","0.002","107.595","0.003","92.877","0.003","110.248","0.003","682.4","0.3","288.2","","288.2","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H36 Co3 O21 -","- C18 H20 Co2.5 O21 -","- C18 H20 Co2.5 O21 -","1","0.5","","Kumagai, Hitoshi; Akita-Tanaka, Motoko; Inoue, Katsuya; Kurmoo, Mohamedally","Hydrothermal synthesis and characterization of a new 3D-network containing the versatile cis,cis-cyclohexane-1,3,5-tricarboxylate","Journal of Materials Chemistry","2001","11","9","2146","","10.1039/b101531l","","","0.7107","MoKα","","0.0416","0.0392","","0.0512","0.0505","","","","0.143","0.148","0.148","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204104","13.849","0.006","14.215","0.008","8.6","0.007","106.78","0.05","94.77","0.05","78.22","0.04","1586.3","1.8","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H14.5 Cl4.5 Ga S12 -","- C17 H12 Cl4.5 Ga S12 -","- C34 H24 Cl9 Ga2 S24 -","2","1","","Katsuhara, Mao; Aragaki, Masanobu; Kimura, Shinya; Mori, Takehiko; Misaki, Yohji; Tanaka, Kazuyoshi","Tetrathiapentalene-based organic conductors with 1 ∶ 1 composition","Journal of Materials Chemistry","2001","11","9","2125","","10.1039/b101542g","","","0.7107","MoKα","","0.0651","0.065","","0.071","","0.071","","","3.407","","","3.41","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204105","14.318","0.004","14.507","0.004","8.54","0.007","105.11","0.04","93.16","0.04","75.44","0.02","1657.4","1.5","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H14.5 Br4 Cl0.5 Ga S12 -","- C8.5 H6 Br2 Cl0.25 Ga0.5 S6 -","- C34 H24 Br8 Cl Ga2 S24 -","4","2","","Katsuhara, Mao; Aragaki, Masanobu; Kimura, Shinya; Mori, Takehiko; Misaki, Yohji; Tanaka, Kazuyoshi","Tetrathiapentalene-based organic conductors with 1 ∶ 1 composition","Journal of Materials Chemistry","2001","11","9","2125","","10.1039/b101542g","","","0.7107","MoKα","","0.1148","0.115","","0.152","","0.152","","","5.993","","","5.99","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204106","14.136","0.002","14.361","0.003","8.571","0.001","105.88","0.01","93.89","0.01","76.65","0.01","1628.3","0.5","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H14.5 Br2 Cl2.5 Ga S12 -","- C17 H12 Br2.921 Cl0.5 Ga S12 -","- C34 H24 Br5.842 Cl Ga2 S24 -","2","1","","Katsuhara, Mao; Aragaki, Masanobu; Kimura, Shinya; Mori, Takehiko; Misaki, Yohji; Tanaka, Kazuyoshi","Tetrathiapentalene-based organic conductors with 1 ∶ 1 composition","Journal of Materials Chemistry","2001","11","9","2125","","10.1039/b101542g","","","0.7107","MoKα","","0.0737","0.074","","0.093","","0.093","","","5.095","","","5.1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204107","24.021","0.007","5.85","0.002","22.435","0.007","90","","118.77","0.02","90","","2763.5","1.6","293.2","","293.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 Cl4 Fe0.9 Ga0.1 S12 -","- C14 H12 Cl4 Fe0.502 S12 -","- C56 H48 Cl16 Fe2.008 S48 -","4","0.5","","Katsuhara, Mao; Aragaki, Masanobu; Kimura, Shinya; Mori, Takehiko; Misaki, Yohji; Tanaka, Kazuyoshi","Tetrathiapentalene-based organic conductors with 1 ∶ 1 composition","Journal of Materials Chemistry","2001","11","9","2125","","10.1039/b101542g","","","0.7107","MoKα","","0.0489","0.049","","0.052","","0.052","","","1.047","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204108","8.6768","0.0007","10.517","0.0003","14.2544","0.0009","69.509","0.007","76.406","0.003","83.126","0.003","1183.33","0.14","113.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 Br4 Fe S9 -","- C11 H8 Br4 Fe S9 -","- C22 H16 Br8 Fe2 S18 -","2","1","","Kominami, Tsuyoshi; Matsumoto, Takuya; Ueda, Kazumasa; Sugimoto, Toyonari; Murata, Keizo; Shiro, Motoo; Fujita, Hideo","Crystal structures and electrical conducting/magnetic properties in 1 ∶ 1 FeCl4 and FeBr4 salts of dimethylthio- and ethylenedithio-(1,3-dithiolylidene)thioxotetrathiafulvalene radical cations","Journal of Materials Chemistry","2001","11","9","2089","","10.1039/b101547h","","","0.7107","MoKα","","","0.0807","","","","0.2141","","","","","","1.906","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204109","15.222","0.003","7.4915","0.0009","18.537","0.003","90","","91.874","0.006","90","","2112.7","0.6","298.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H6 Cl4 Fe S9 -","- C11 H6 Cl4 Fe S9 -","- C44 H24 Cl16 Fe4 S36 -","4","1","","Kominami, Tsuyoshi; Matsumoto, Takuya; Ueda, Kazumasa; Sugimoto, Toyonari; Murata, Keizo; Shiro, Motoo; Fujita, Hideo","Crystal structures and electrical conducting/magnetic properties in 1 ∶ 1 FeCl4 and FeBr4 salts of dimethylthio- and ethylenedithio-(1,3-dithiolylidene)thioxotetrathiafulvalene radical cations","Journal of Materials Chemistry","2001","11","9","2089","","10.1039/b101547h","","","0.7107","MoKα","","","0.0559","","","","0.1035","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204110","15.464","0.001","7.4292","0.0004","19.085","0.001","90","","92.438","0.005","90","","2190.6","0.2","298.3","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H6 Br4 Fe S9 -","- C11 H6 Br4 Fe S9 -","- C44 H24 Br16 Fe4 S36 -","4","1","","Kominami, Tsuyoshi; Matsumoto, Takuya; Ueda, Kazumasa; Sugimoto, Toyonari; Murata, Keizo; Shiro, Motoo; Fujita, Hideo","Crystal structures and electrical conducting/magnetic properties in 1 ∶ 1 FeCl4 and FeBr4 salts of dimethylthio- and ethylenedithio-(1,3-dithiolylidene)thioxotetrathiafulvalene radical cations","Journal of Materials Chemistry","2001","11","9","2089","","10.1039/b101547h","","","0.7107","MoKα","","","0.0662","","","","0.1272","","","","","","1.028","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204111","7.606","0.003","6.773","0.003","34.531","0.002","90","","93.12","0.01","90","","1776.2","1.1","296.2","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H17 N2 O4 S16 -","- C28 H17 N2 O4 S16 -","- C56 H34 N4 O8 S32 -","2","0.5","","Zaman, Md. B.; Toyoda, J.; Morita, Y.; Nakamura, S.; Yamochi, H.; Saito, G.; Nishimura, K.; Yoneyama, N.; Enoki, T.; Nakasuji, K.","Preparation of a Mott insulator based on a BEDT-TTF charge transfer complex of hydrogen cyananilate: α'-(BEDT-TTF)2HCNAL","Journal of Materials Chemistry","2001","11","9","2211","","10.1039/b101635k","","","0.7107","MoKα","","","0.0378","","","","0.037","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204115","11.2031","0.0006","11.2031","0.0006","3.6001","0.0003","90","","90","","90","","451.85","0.05","300","","300","","","","","","","","","6","P 42/m n m","-P 4n 2n","136","","","","- C6.26 H4 Cl0.43 N0.26 S4 Se0.26 -","- C6.26 H4 Cl0.43 S4 -","- C12.52 H8 Cl0.86 S8 -","2","0.125","","Mizuno, Masagi; Kokubo, Hisashi; Honda, Kazumasa","Preparation, structure and conduction properties of SeCN-containing mixed anion TTF conductors","Journal of Materials Chemistry","2001","11","9","2192","","10.1039/b101864g","","","0.7107","MoKα","","0.1261","0.0815","","0.1086","","0.1063","","","","","","4.043","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204116","4.19","0.001","11.746","0.002","14.294","0.003","95.18","0.01","91.92","0.01","96.69","0.01","695.2","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4,4',5,5'-tetraiodotetrathiafulvalene","","- C6 I4 S4 -","- C6 I4 S4 -","- C12 I8 S8 -","2","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0606","0.054","","0.1533","0.1409","","","","1.14","1.165","1.165","","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204117","6.225","0.001","15.209","0.002","6.766","0.001","90","","96.65","0.01","90","","636.27","0.16","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-iodo-4',5,5'-trimethyltetrathiafulvalene","","- C9 H9 I S4 -","- C8.742 H8.325 I0.999 S4 -","- C17.484 H16.65 I1.998 S8 -","2","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.1238","0.0782","","0.2208","0.1643","","","","1.272","1.243","1.243","","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204118","6.033","0.002","6.83","0.001","7.862","0.004","107.7","0.02","103.17","0.01","95.81","0.01","295.38","0.19","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","4-bromo-4',5,5'-trimethyltetrathiafulvalene","","- C9 H9 Br S4 -","- C9 H9 Br S4 -","- C9 H9 Br S4 -","1","0.5","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0783","0.0556","","0.1555","0.1197","","","","1.173","1.173","1.173","","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204119","6.0472","0.0003","6.7723","0.0004","7.7964","0.0004","107.635","0.002","103.913","0.002","96.561","0.002","289.25","0.03","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","4,4',5,5'-tetramethyltetrathiafulvalene","","- C10 H12 S4 -","- C10 H12 S4 -","- C10 H12 S4 -","1","0.5","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0287","0.0247","","","0.0633","0.0656","","","","","","1.066","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204120","14.609","0.001","11.607","0.001","21.02","0.001","90","","90","","90","","3564.3","0.4","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4,5-dibromo-4',5'-bis(2'-cyanoethylsulfanyl)- tetrathiafulvalene","","- C12 H8 Br2 N2 S6 -","- C12 H8 Br2 N2 S6 -","- C96 H64 Br16 N16 S48 -","8","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0411","0.0291","","0.0655","0.0571","","","","1.209","1.185","1.185","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204121","7.635","0.001","7.959","0.002","20.021","0.003","81.2","0.01","88.64","0.01","87.21","0.01","1200.7","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","4-iodo-5-methyl-4',5'-bis(methylsulfanyl)tetrathiafulvalene 7,7,8,8-tetracyanoquinodimethane","","- C21 H13 I N4 S6 -","- C21 H13 I N4 S6 -","- C42 H26 I2 N8 S12 -","2","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0528","0.0407","","0.0923","0.0801","","","","1.242","1.228","1.228","","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204122","7.969","0.001","9.066","0.001","17.482","0.001","81.02","0.01","83.25","0.01","77.12","0.01","1211.7","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","4-iodo-4',5'-bis(methylsulfanyl)tetrathiafulvalene 7,7,8,8-tetracyanoquinodimethane","","- C20 H11 I N4 S6 -","- C20 H10.97 I N4 S6 -","- C40 H21.94 I2 N8 S12 -","2","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0777","0.0412","","0.0939","0.0761","","","","1.077","1.093","1.093","","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204123","14.034","0.001","8.077","0.001","17.96","0.001","90","","107.2","0.01","90","","1944.8","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-iodo-4',5,5'-trimethyltetrathiafulvalenium triiodide hemi(diiodine)","","- C9 H9 I5 S4 -","- C9 H9 I5 S4 -","- C36 H36 I20 S16 -","4","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.1174","0.0766","","0.2244","0.1772","","","","1.177","1.248","1.248","","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204124","7.098","0.001","16.255","0.001","16.541","0.001","90","","90","","90","","1908.5","0.3","150","2","150","2","","","","","","","","5","C m c m","-C 2c 2","63","","4,5-dibromo-4',5'-bis(methylsulfanyl)tetrathiafulvalenium triiodide","","- C8 H6 Br2 I3 S6 -","- C8 H6 Br2 I3 S6 -","- C32 H24 Br8 I12 S24 -","4","0.25","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0305","0.0245","","0.0614","0.0561","","","","1.188","1.178","1.178","","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204125","10.178","0.001","24.49","0.001","14.101","0.001","90","","100.99","0.01","90","","3450.3","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-iodotetrathiafulvalene 2,4,5,7-tetranitro-9- dicyanomethylenefluorene bis-dioxane","","- C30 H23 I N6 O12 S4 -","- C30 H23 I N6 O12 S4 -","- C120 H92 I4 N24 O48 S16 -","4","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","0.71073","MoKα","","0.0507","0.0344","","0.0764","0.063","","","","1.19","1.159","1.159","","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204126","11.209","0.004","7.16","0.003","29.917","0.003","90","","94.03","0.02","90","","2395.1","1.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,4,7-trinitro-9-dicyanomethylenefluorene 4-iodotetrathiafulvalene","","- C22 H8 I N5 O6 S4 -","- C22 H7 I N5 O6 S4 -","- C88 H28 I4 N20 O24 S16 -","4","1","","Batsanov, Andrei S.; Bryce, Martin R.; Chesney, Antony; Howard, Judith A. K.; John, Derek E.; Moore, Adrian J.; Wood, Clare L.; Gershtenman, Hagit; Becker, James Y.; Khodorkovsky, Vladimir Y.; Ellern, Arkady; Bernstein, Joel; Perepichka, Igor F.; Rotello, Vincent; Gray, Mark; Cuello, Alejandro O.","Synthesis and crystal engineering of new halogenated tetrathiafulvalene (TTF) derivatives and their charge transfer complexes and radical ion salts","Journal of Materials Chemistry","2001","11","9","2181","","10.1039/b101866n","","","1.54178","CuKα","","0.1581","0.1299","","","0.3127","0.3381","","","","","","1.285","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204127","19.872","0.001","19.7547","0.0008","12.6242","0.0006","90","","95.442","0.001","90","","4933.5","0.4","297","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H32 Ca Ni2 O8 S20 -","- C28 H32 Ca Ni2 O8 S20 -","- C112 H128 Ca4 Ni8 O32 S80 -","4","1","","Akutagawa, Tomoyuki; Takamatsu, Nobuhiro; Shitagami, Kozo; Hasegawa, Tatsuo; Nakamura, Takayoshi; Inabe, Tamotsu; Fujita, Wataru; Awaga, Kunio","Diversity in the ½ spin arrangement of [Ni(dmit)2]‒ anions in divalent Ca2+(crown ether) supramolecular cation salts","Journal of Materials Chemistry","2001","11","9","2118","","10.1039/b101873f","","","0.7107","MoKα","","","0.041","","","0.05","","","","","1.776","1.776","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204128","19.8366","0.0002","19.5053","0.0003","12.5358","0.0004","90","","94.761","0.0002","90","","4833.6","0.18","150.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H32 Ca Ni2 O8 S20 -","- C28 H32 Ca Ni2 O8 S20 -","- C112 H128 Ca4 Ni8 O32 S80 -","4","1","","Akutagawa, Tomoyuki; Takamatsu, Nobuhiro; Shitagami, Kozo; Hasegawa, Tatsuo; Nakamura, Takayoshi; Inabe, Tamotsu; Fujita, Wataru; Awaga, Kunio","Diversity in the ½ spin arrangement of [Ni(dmit)2]‒ anions in divalent Ca2+(crown ether) supramolecular cation salts","Journal of Materials Chemistry","2001","11","9","2118","","10.1039/b101873f","","","0.7107","MoKα","","","0.023","","","","0.037","","","","","","1.79","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204129","12.4442","0.0004","12.5299","0.0004","26.872","0.001","97.067","0.0007","91.7234","0.0008","97.214","0.001","4120.8","0.2","293.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C33.33333 H42 Ca N0.66667 Ni2 O10 S20 -","- C33.3333 H42 Ca N0.666667 Ni2 O10 S20 -","- C100 H126 Ca3 N2 Ni6 O30 S60 -","3","1.5","","Akutagawa, Tomoyuki; Takamatsu, Nobuhiro; Shitagami, Kozo; Hasegawa, Tatsuo; Nakamura, Takayoshi; Inabe, Tamotsu; Fujita, Wataru; Awaga, Kunio","Diversity in the ½ spin arrangement of [Ni(dmit)2]‒ anions in divalent Ca2+(crown ether) supramolecular cation salts","Journal of Materials Chemistry","2001","11","9","2118","","10.1039/b101873f","","","0.7107","MoKα","","","0.0493","","","0.126","","","","","1.596","1.596","","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204130","15.598","0.003","15.5975","","10.222","0.004","90","","90","","90","","2486.9","1.1","296.1","","","","","","","","","","","7","P 42/m n m","-P 4n 2n","136","","","","- C28 H31 Ca N3 Ni2 O5 S20 -","- C28 Ca N4 Ni2 O4 S20 -","- C56 Ca2 N8 Ni4 O8 S40 -","2","0.125","","Akutagawa, Tomoyuki; Takamatsu, Nobuhiro; Shitagami, Kozo; Hasegawa, Tatsuo; Nakamura, Takayoshi; Inabe, Tamotsu; Fujita, Wataru; Awaga, Kunio","Diversity in the ½ spin arrangement of [Ni(dmit)2]‒ anions in divalent Ca2+(crown ether) supramolecular cation salts","Journal of Materials Chemistry","2001","11","9","2118","","10.1039/b101873f","","","0.7107","MoKα","","","0.05","","","0.081","","","","","3.47","3.47","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204131","10.16","0.007","13.851","0.003","13.678","0.001","90","0","96.57","0.02","90","0","1912.2","1.4","295","2","","","","","","","","","Local laboratory","5","P 1 21/a 1","-P 2yab","14","","","","?","- C32 H32 N4 Ni0.5 S14 -","- C64 H64 N8 Ni S28 -","2","0.5","","Yamochi, Hideki; Sogoshi, Norihito; Simizu, Yasuhiro; Saito, Gunzi; Matsumoto, Kiyoshi","The crystal and electronic structure analysis of (OMTTF)2[Ni(tdas)2]","Journal of Materials Chemistry","2001","11","9","2216","","10.1039/b101909k","","","0.71073","MoK-alpha","","","0.055","","","","","","","","2.73","2.73","","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204136","7.804","0.004","36.171","0.018","6.284","0.002","91.68","0.04","112.08","0.04","88.79","0.05","1642.9","1.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H13 Pd2 S21 -","- C17 H13 Pd2 S21 -","- C34 H26 Pd4 S42 -","2","1","","Faulmann, C.; Doublet, M.-L.; Granier, F.; Garreau de Bonneval, B.; Malfant, I.; Legros, J.-P.; Togonidze, T.; Cassoux, P.","Synthesis, electrical behaviour, and crystal and electronic band structures of two different phases of the (SMeEt2)[Pd(dmit)2]2 salt. Consequences of cationic disorder on the electrical properties","Journal of Materials Chemistry","2001","11","9","2205","","10.1039/b102133h","","","0.71073","MoKα","","0.1022","0.0651","","","0.1708","0.1987","","","","","","1.15","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7204137","7.7888","0.0009","36.181","0.003","6.2573","0.0006","92.112","0.011","112.169","0.012","88.74","0.012","1631.8","0.3","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H13 Pd2 S21 -","- C17 H13 Pd2 S21 -","- C34 H26 Pd4 S42 -","2","1","","Faulmann, C.; Doublet, M.-L.; Granier, F.; Garreau de Bonneval, B.; Malfant, I.; Legros, J.-P.; Togonidze, T.; Cassoux, P.","Synthesis, electrical behaviour, and crystal and electronic band structures of two different phases of the (SMeEt2)[Pd(dmit)2]2 salt. Consequences of cationic disorder on the electrical properties","Journal of Materials Chemistry","2001","11","9","2205","","10.1039/b102133h","","","0.71073","MoKα","","0.0962","0.0861","","","0.2233","0.2292","","","","","","1.175","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204138","7.7877","0.0012","18.323","0.003","6.2846","0.001","96.8","0.02","112.257","0.018","84.17","0.02","822.5","0.3","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H13 Pd2 S21 -","- C17 H13 Pd2 S21 -","- C17 H13 Pd2 S21 -","1","0.5","","Faulmann, C.; Doublet, M.-L.; Granier, F.; Garreau de Bonneval, B.; Malfant, I.; Legros, J.-P.; Togonidze, T.; Cassoux, P.","Synthesis, electrical behaviour, and crystal and electronic band structures of two different phases of the (SMeEt2)[Pd(dmit)2]2 salt. Consequences of cationic disorder on the electrical properties","Journal of Materials Chemistry","2001","11","9","2205","","10.1039/b102133h","","","0.71073","MoKα","","0.0368","0.0346","","","0.0925","0.0939","","","","","","1.11","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7204139","7.844","0.005","18.397","0.005","6.32","0.005","97.654","0.005","112.076","0.005","83.572","0.005","835.7","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H13 Pd2 S21 -","- C17 H13 Pd2 S21 -","- C17 H13 Pd2 S21 -","1","0.5","","Faulmann, C.; Doublet, M.-L.; Granier, F.; Garreau de Bonneval, B.; Malfant, I.; Legros, J.-P.; Togonidze, T.; Cassoux, P.","Synthesis, electrical behaviour, and crystal and electronic band structures of two different phases of the (SMeEt2)[Pd(dmit)2]2 salt. Consequences of cationic disorder on the electrical properties","Journal of Materials Chemistry","2001","11","9","2205","","10.1039/b102133h","","","0.71069","MoKα","","0.057","0.0312","","","0.0702","0.079","","","","","","1.02","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204140","8.581","0.005","8.507","0.006","8.033","0.006","108.39","0.06","112.48","0.05","101.46","0.05","478.9","0.7","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C14 H26 In2 O4 -","- C14 H26 In2 O4 -","- C14 H26 In2 O4 -","1","0.5","","Park, Jin-Ho; Horley, Graeme A.; O'Brien, Paul; Jones, Anthony C.; Motevalli, Majid","The X-ray single crystal structure of [Me2In(acac)]2 and its use as a single-source precursor for the deposition of indium oxide thin films","Journal of Materials Chemistry","2001","11","9","2346","","10.1039/b102212l","","","0.71073","MoKα","","0.0199","0.019","","","0.0501","0.0505","","","","","","1.199","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204141","9.2248","0.0015","14.095","0.002","17.05","0.002","92.524","0.01","105.622","0.009","101.51","","2080.8","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H16 Au2 N8 S8 Se8 -","- C28 H16 Au2 N8 S8 Se8 -","- C56 H32 Au4 N16 S16 Se16 -","2","1","","Morgado, Jorge; Santos, Isabel C.; Veiros, Luís F.; Rodrigues, César; Henriques, Rui T.; Duarte, M. Teresa; Alcácer, Luís; Almeida, Manuel","Preparation, structural, electrical and magnetic properties of tetrathiafulvalene-Au(pds)2 salts (pds = pyrazine-2,3-diselenolate)","Journal of Materials Chemistry","2001","11","9","2108","","10.1039/b102220m","","","0.71069","MoKα","","0.1838","0.0714","","","0.1506","0.2207","","","","","","1.113","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204142","22.437","0.009","10.981","0.001","10.854","0.005","90","","91.79","0.02","90","","2672.9","1.7","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C8.5 H5 Au0.5 N2 S3 Se2 -","- C8.5 H5 Au0.5 N2 S3 Se2 -","- C68 H40 Au4 N16 S24 Se16 -","8","1","","Morgado, Jorge; Santos, Isabel C.; Veiros, Luís F.; Rodrigues, César; Henriques, Rui T.; Duarte, M. Teresa; Alcácer, Luís; Almeida, Manuel","Preparation, structural, electrical and magnetic properties of tetrathiafulvalene-Au(pds)2 salts (pds = pyrazine-2,3-diselenolate)","Journal of Materials Chemistry","2001","11","9","2108","","10.1039/b102220m","","","0.71069","MoKα","","0.1646","0.0554","","","0.1412","0.1538","","","","","","0.907","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204143","9.775","0.002","20.404","0.002","15.424","0.002","90","","95.25","0.02","90","","3063.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H12 Au1.5 N6 S6 Se6 -","- C21 H12 Au1.5 N6 S6 Se6 -","- C84 H48 Au6 N24 S24 Se24 -","4","1","","Morgado, Jorge; Santos, Isabel C.; Veiros, Luís F.; Rodrigues, César; Henriques, Rui T.; Duarte, M. Teresa; Alcácer, Luís; Almeida, Manuel","Preparation, structural, electrical and magnetic properties of tetrathiafulvalene-Au(pds)2 salts (pds = pyrazine-2,3-diselenolate)","Journal of Materials Chemistry","2001","11","9","2108","","10.1039/b102220m","","","0.71069","MoKα","","0.1092","0.0682","","","0.1402","0.1573","","","","","","1.129","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204145","14.603","0.003","6.3722","0.0011","36.335","0.006","90","","90.02","0.01","90","","3381.1","1.1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Quinuclidinium bis(1,3-dithiol-2-thione-4,5-dithiolato)palladium at 298K","","- C19 H14 N Pd2 S20 -","- C19 H14 N Pd2 S20 -","- C76 H56 N4 Pd8 S80 -","4","0.5","","Naito, T.; Inabe, T.; Kobayashi, H.; Kobayashi, A.","A new molecular metal based on Pd(dmit)2: synthesis, structure and electrical properties of (C7H13NH)[Pd(dmit)2]2 (dmit2‒ = 2-thioxo-1,3-dithiole-4,5-dithiolate)","Journal of Materials Chemistry","2001","11","9","2199","","10.1039/b102260c","","","0.71073","MoKα","","0.0834","0.0766","","","0.2465","0.2506","","","","","","1.253","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7204146","14.5","0.02","6.333","0.009","36.13","0.05","90","","90.14","0.1","90","","3318","8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Qinuclidinium bis(1,3-dithiol-2-thione-4,5-dithiolato)palladium at 150K","","- C19 H14 N Pd2 S20 -","- C19 H14 N Pd2 S20 -","- C76 H56 N4 Pd8 S80 -","4","0.5","","Naito, T.; Inabe, T.; Kobayashi, H.; Kobayashi, A.","A new molecular metal based on Pd(dmit)2: synthesis, structure and electrical properties of (C7H13NH)[Pd(dmit)2]2 (dmit2‒ = 2-thioxo-1,3-dithiole-4,5-dithiolate)","Journal of Materials Chemistry","2001","11","9","2199","","10.1039/b102260c","","","0.71073","MoKα","","0.1424","0.1247","","","0.3151","0.3269","","","","","","1.146","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7204147","15.798","0.001","4.8939","0.0003","17.99","0.001","90","","114.816","0.004","90","","1262.44","0.14","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- Al1.75 Ce3 N9.25 O5.75 Si6.25 -","- Al1.76 Ce3 N9.22 O5.78 Si6.24 -","- Al7.04 Ce12 N36.88 O23.12 Si24.96 -","4","0.5","","Grins, Jekabs; Shen, Zhijian; Esmaeilzadeh, Saeid; Berastegui, Pedro","The structures of the Ce and La N-phases RE3Si8 ‒ xAlxN11 ‒ xO4 + x (x≈ 1.75 for RE = Ce, x ≈ 1.5 for RE = La), determined by single-crystal X-ray and time-of-flight neutron powder diffraction, respectively","Journal of Materials Chemistry","2001","11","9","2358","","10.1039/b102340n","","","0.71073","MoKα","","0.0446","0.0313","","","0.0639","0.0671","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204148","7.987","0.002","10.3","0.003","10.806","0.003","118.308","0.004","106.121","0.004","94.752","0.004","727.3","0.3","158","2","158","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H16 N2 O4 -","- C17 H16 N2 O4 -","- C34 H32 N4 O8 -","2","1","","Kay, A. J.; Woolhouse, A. D.; Gainsford, G. J.; Haskell, T. G.; Wyss, C. P.; Giffin, S. M.; McKinnie, I. T.; Barnes, T. H.","Simple zwitterionic merocyanines as potential NLO chromophores","Journal of Materials Chemistry","2001","11","9","2271","","10.1039/b103148c","","","0.71073","MoKα","","0.0449","0.0392","","","0.1079","0.1116","","","","","","1.084","","","","has coordinates,has disorder","180372","2020-10-21","18:00:00",""
"7204153","7.737","0.008","10.309","0.007","11.812","0.008","105.97","0.08","104.33","0.11","97.56","0.11","857.2","1.4","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H25 N Ni O5 -","- C14 H25 N Ni O5 -","- C28 H50 N2 Ni2 O10 -","2","1","","Williams, Paul A.; Jones, Anthony C.; Bickley, Jamie F.; Steiner, Alexander; Davies, Hywel O.; Leedham, Timothy J.; Impey, Susan A.; Garcia, Joanne; Allen, Stephen; Rougier, Aline; Blyr, Alexandra","Synthesis and crystal structures of dimethylaminoethanol adducts of Ni(ii) acetate and Ni(ii) acetylacetonate. Precursors for the sol‒gel deposition of electrochromic nickel oxide thin films","Journal of Materials Chemistry","2001","11","9","2329","","10.1039/b103288g","","","0.71073","MoKα","","0.0651","0.0463","","","0.1063","0.1141","","","","","","0.925","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204154","8.2993","0.0014","8.5256","0.0014","13.017","0.002","95.917","0.019","95.92","0.02","109.469","0.019","854.4","0.3","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H28 N2 Ni O6 -","- C12 H28 N2 Ni O6 -","- C24 H56 N4 Ni2 O12 -","2","1","","Williams, Paul A.; Jones, Anthony C.; Bickley, Jamie F.; Steiner, Alexander; Davies, Hywel O.; Leedham, Timothy J.; Impey, Susan A.; Garcia, Joanne; Allen, Stephen; Rougier, Aline; Blyr, Alexandra","Synthesis and crystal structures of dimethylaminoethanol adducts of Ni(ii) acetate and Ni(ii) acetylacetonate. Precursors for the sol‒gel deposition of electrochromic nickel oxide thin films","Journal of Materials Chemistry","2001","11","9","2329","","10.1039/b103288g","","","0.71073","MoKα","","0.0473","0.0333","","","0.0727","0.0755","","","","","","0.914","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204158","11.2089","0.0007","11.2083","0.0006","8.4747","0.0005","90","","90","","90","","1064.7","0.11","293","2","293","2","","","","","","","","4","I m m 2","I 2 -2","44","","","","- C8 Cd2 O22.31 Zr -","- C8 Cd2 O22.31 Zr -","- C16 Cd4 O44.62 Zr2 -","2","0.25","","Jeanneau, Erwann; Audebrand, Nathalie; Auffrédic, Jean-Paul; Louër, Daniel","Crystal structure, thermal behaviour and zeolitic properties of Cd2Zr(C2O4)4·(4 + n)H2O","Journal of Materials Chemistry","2001","11","10","2545","","10.1039/b103711k","","","0.71073","MoKα","","0.1011","0.0677","","","0.1719","0.192","","","","","","1.09","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204159","22.6131","0.0001","23.0681","0.0003","30.8375","0.0004","90","","90","","90","","16086.1","0.3","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C30 H30 Cu4 I2 N6 S4 W -","- C30 H30 Cu4 I2 N6 S4 W -","- C480 H480 Cu64 I32 N96 S64 W16 -","16","1","","Zhang, Chi; Song, Yinglin; Kühn, Fritz E.; Wang, Yuxiao; Fun, Hoongkun; Xin, Xinquan","Study on a series of pentanuclear planar 'open' clusters: synthesis, characterization, strong third-order optical nonlinearities and superior optical limiting properties","Journal of Materials Chemistry","2002","12","2","239","","10.1039/b103839g","","","0.71073","MoKα","","0.0454","0.0352","","","0.0761","0.0811","","","","","","1.097","","","","has coordinates","180372","2020-10-21","18:00:00",""
"7204160","22.5897","0.0001","22.8053","0.0003","30.1995","0.0003","90","","90","","90","","15557.7","0.3","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C30 H30 Br2 Cu4 N6 S4 W -","- C30 H30 Br2 Cu4 N6 S4 W -","- C480 H480 Br32 Cu64 N96 S64 W16 -","16","1","","Zhang, Chi; Song, Yinglin; Kühn, Fritz E.; Wang, Yuxiao; Fun, Hoongkun; Xin, Xinquan","Study on a series of pentanuclear planar 'open' clusters: synthesis, characterization, strong third-order optical nonlinearities and superior optical limiting properties","Journal of Materials Chemistry","2002","12","2","239","","10.1039/b103839g","","","0.71073","MoKα","","0.0747","0.0432","","","0.0977","0.1114","","","","","","1.008","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204161","22.5496","0.0001","22.7445","0.0003","30.2498","0.0004","90","","90","","90","","15514.5","0.3","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C30 H30 Br2 Cu4 Mo N6 S4 -","- C30 H30 Br2 Cu4 Mo N6 S4 -","- C480 H480 Br32 Cu64 Mo16 N96 S64 -","16","1","","Zhang, Chi; Song, Yinglin; Kühn, Fritz E.; Wang, Yuxiao; Fun, Hoongkun; Xin, Xinquan","Study on a series of pentanuclear planar 'open' clusters: synthesis, characterization, strong third-order optical nonlinearities and superior optical limiting properties","Journal of Materials Chemistry","2002","12","2","239","","10.1039/b103839g","","","0.71073","MoKα","","0.0827","0.0479","","","0.0966","0.1099","","","","","","1.042","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204162","12.633","0.003","3.901","0.003","18.557","0.002","90","","104.24","0.01","90","","886.4","0.7","296.2","","296.2","","","","","","","","synthesized","4","P 1 21/c 1","-P 2ybc","14","TSTeF-TCNQ","","","- C18 H8 N4 Se4 -","- C18 H8 N4 Se4.54 -","- C36 H16 N8 Se9.08 -","2","0.5","","Morikami, Atsushi; Takimiya, Kazuo; Aso, Yoshio; Otsubo, Tetsuo","Novel tellurium containing fulvalene-type electron donors, triselenatellurafulvalene (TSTeF) and diselenaditellurafulvalene (DSDTeF); synthesis, conductivities and crystal structures of their TCNQ complexes","Journal of Materials Chemistry","2001","11","10","2431","","10.1039/b104402h","","","0.7107","MoKα","","0.0241","0.0241","","","0.0215","0.0215","","","","","","2.881","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204163","7.271","0.003","16.735","0.009","3.876","0.002","96.38","0.05","98.17","0.04","87.04","0.04","463.6","0.4","296.2","","296.2","","","","","","","","synthesized","5","P -1","-P 1","2","DSDTeF-TCNQ","","","- C18 H8 N4 Se2 Te2 -","- C18 H8 N4 Se2 Te2 -","- C18 H8 N4 Se2 Te2 -","1","0.5","","Morikami, Atsushi; Takimiya, Kazuo; Aso, Yoshio; Otsubo, Tetsuo","Novel tellurium containing fulvalene-type electron donors, triselenatellurafulvalene (TSTeF) and diselenaditellurafulvalene (DSDTeF); synthesis, conductivities and crystal structures of their TCNQ complexes","Journal of Materials Chemistry","2001","11","10","2431","","10.1039/b104402h","","","0.7107","MoKα","","0.0516","0.0516","","","0.0518","0.0518","","","","","","4.118","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204164","9.088","0.003","10.845","0.003","8.875","0.003","106.46","0.03","109.79","0.03","104.14","0.03","731.1","0.5","296.2","","296.2","","","","","","","","synthesized","4","P -1","-P 1","2","DSDTeF","","","- C6 H4 Se2 Te2 -","- C6 H4 Se2.33333 Te1.78667 -","- C18 H12 Se7 Te5.36 -","3","1.5","","Morikami, Atsushi; Takimiya, Kazuo; Aso, Yoshio; Otsubo, Tetsuo","Novel tellurium containing fulvalene-type electron donors, triselenatellurafulvalene (TSTeF) and diselenaditellurafulvalene (DSDTeF); synthesis, conductivities and crystal structures of their TCNQ complexes","Journal of Materials Chemistry","2001","11","10","2431","","10.1039/b104402h","","","0.7107","MoKα","","0.0381","0.0378","","","0.0436","0.0437","","","","","","3.157","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204166","6.651","0.0003","9.343","0.0006","14.512","0.001","87.687","0.003","84.096","0.004","89.066","0.004","896.2","0.09","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C3 H20 Mn2 N3 O16 P4 -","- C3 H18 Mn2 N3 O16 P4 -","- C6 H36 Mn4 N6 O32 P8 -","2","1","","Ann M. Chippindale; Fabrice O. M. Gaslain; Andrew R. Cowley; Anthony V. Powell","Synthesis and characterisation of a layered organically-templated manganese phosphate, [Mn2(HPO4)3]·(NH3(CH2)2NH3)3/2·H2PO4, and its reaction with water","J. Mater. Chem.","2001","11","12","3172","3179","10.1039/b104491p","","","0.71069","MoKα","","","0.0409","","","0.0462","","","","","1.0398","1.0398","","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7204167","17.5592","0.0004","12.9874","0.0002","6.6031","0.0001","90","","112.004","0.001","90","","1396.14","0.04","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C9 H15 Fe1.5 O12 -","- C9 H3 Fe1.5 O12 -","- C36 H12 Fe6 O48 -","4","1","","Myriam Riou-Cavellec; Catherine Albinet; Jean-Marc Grenèche; Gérard Férey","Study of the iron/trimesic acid system for the hydrothermal synthesis of hybrid materials","J. Mater. Chem.","","11","12","3166","3171","10.1039/b104495h","","","0.71073","MoKα","","0.0609","0.0578","","0.1606","0.154","","","","1.056","1.04","1.04","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204168","5.1572","0.0003","13.0703","0.0008","15.2673","0.001","90","","97.209","0.002","90","","1020.97","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H9 Fe0.5 O8 -","- C9 H9 Fe0.5 O8 -","- C36 H36 Fe2 O32 -","4","1","","Myriam Riou-Cavellec; Catherine Albinet; Jean-Marc Grenèche; Gérard Férey","Study of the iron/trimesic acid system for the hydrothermal synthesis of hybrid materials","J. Mater. Chem.","","11","12","3166","3171","10.1039/b104495h","","","0.71073","MoKα","","0.0894","0.0514","","0.1297","0.1111","","","","1.032","1.094","1.094","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204171","17.014","0.0004","11.214","0.0003","18.405","0.0004","90","","112.716","0.002","90","","3239.19","0.14","100","","100","","","","","","","","","5","P 1 21 1","P 2yb","4","","2'-deoxy-3',5'-O-bis(triisopropylsilyl)-guanosine","","- C28 H53 N5 O4 Si2 -","- C28 H53 N5 O4 Si2 -","- C112 H212 N20 O16 Si8 -","4","2","","Takafumi Sato; Masayuki Seko; Ryoichi Takasawa; Isao Yoshikawa; Koji Araki","Mesoscopic-scale sheet-like assembly: critical role of inter-tape hydrogen bonds in the organogel formation and gel‒liquid crystal transition of an alkylsilylated deoxyguanosine‒dodecane system","J. Mater. Chem.","","11","12","3018","3022","10.1039/b105000c","","","1.54184","CuKα","","0.0552","0.0547","","","0.1514","0.1535","","","","","","1.052","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204172","9.53","0.0001","11.075","0.0001","39.422","0.0003","90","","90","","90","","4160.79","0.07","100","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2'-deoxy-3',5'-O-bis(tert-butyldiphenylsilyl)-guanosine","","- C42 H49 N5 O4 Si2 -","- C42 H49 N5 O4 Si2 -","- C168 H196 N20 O16 Si8 -","4","1","","Takafumi Sato; Masayuki Seko; Ryoichi Takasawa; Isao Yoshikawa; Koji Araki","Mesoscopic-scale sheet-like assembly: critical role of inter-tape hydrogen bonds in the organogel formation and gel‒liquid crystal transition of an alkylsilylated deoxyguanosine‒dodecane system","J. Mater. Chem.","","11","12","3018","3022","10.1039/b105000c","","","1.54184","CuKα","","0.0658","0.0637","","","0.1776","0.1885","","","","","","1.044","","","","has coordinates","213974","2020-10-21","18:00:00",""
"7204174","10.7076","0.0005","13.6925","0.0005","15.3195","0.0006","65.773","0.002","70.237","0.002","88.749","0.002","1909.62","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","p-tetrakis(4-nitrophenylazo)-tetrahydroxythiacalix[4]arene","p-tetrakis(4-nitrophenylazo)-tetrahydroxythiacalix[4]arene","","- C83 H63 N19 O12 S4 -","- C83 H63 N19 O12 S4 -","- C83 H63 N19 O12 S4 -","1","0.5","","Cédric Desroches; Stéphane Parola; Francis Vocanson; Noëlle Ehlinger; Philippe Miele; Roger Lamartine; Jean Bouix; Anders Eriksson; Mikael Lindgren; Cesar Lopes","Synthesis, characterization and optical power limiting behaviour of phenylazo- and 4-nitrophenylazo-tetrahydroxytetrathiacalix[4]arene","J. Mater. Chem.","","11","12","3014","3017","10.1039/b105034f","","","0.71073","MoKα","","0.1571","0.0764","","","0.1906","0.2409","","","","","","1.012","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204175","12.955","0.001","8.295","0.001","18.805","0.002","90","","91.34","0.01","90","","2020.3","0.4","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Hexane-1,6-diammonium zinc phosphate hydrogenphosphate boric-acid (1/3/2/1/1)","","- C6 H22 B N2 O15 P3 Zn3 -","- C6 H21 B N2 O15 P3 Zn3 -","- C24 H84 B4 N8 O60 P12 Zn12 -","4","1","","Michael Wiebcke","Hydrothermal synthesis and structural characterization of a new layered zincophosphate co-templated by diprotonated 1,6-diaminohexane and orthoboric acid molecules","J. Mater. Chem.","2002","12","1","143","147","10.1039/b105057p","","","0.71073","MoKα","","0.1594","0.0523","","","0.0776","0.097","","","","","","0.989","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204176","12.351","0.002","23.632","0.004","7.603","0.001","90","0","101.47","0.01","90","0","2174.8","0.6","298","","","","","","","","","","Local laboratory","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H11 N4 O S4 -","- C26 H11 N4 O S4 -","- C104 H44 N16 O4 S16 -","4","1","","Sekizaki, Shuichi; Tada, Chiyoko; Yamochi, Hideki; Saito, Gunzi","Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA‒; R = Me, Et, Prn, Bun)","Journal of Materials Chemistry","2001","11","9","2293","","10.1039/b105340j","","","0.71073","MoK-alpha","","","0.041","","","0.046","","","","","2.303","2.303","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204177","7.573","0.001","14.909","0.001","23.061","0.002","74.423","0.004","88.636","0.005","83.511","0.005","2492","0.4","298","","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C27 H15 N4 O1.25 S4 -","- C28 H13 N4 O1.25 S4 -","- C112 H52 N16 O5 S16 -","4","2","","Sekizaki, Shuichi; Tada, Chiyoko; Yamochi, Hideki; Saito, Gunzi","Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA‒; R = Me, Et, Prn, Bun)","Journal of Materials Chemistry","2001","11","9","2293","","10.1039/b105340j","","","0.71073","MoK-alpha","","","0.039","","","0.042","","","","","1.289","1.289","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204178","20.971","0.007","21.949","0.008","14.078","0.005","90","0","128.7","0.02","90","0","5057","3","298","","","","","","","","","","Local laboratory","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H17 N4 O S4 -","- C29 H17 N4 O S4 -","- C232 H136 N32 O8 S32 -","8","1","","Sekizaki, Shuichi; Tada, Chiyoko; Yamochi, Hideki; Saito, Gunzi","Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA‒; R = Me, Et, Prn, Bun)","Journal of Materials Chemistry","2001","11","9","2293","","10.1039/b105340j","","","0.71073","MoK-alpha","","","0.048","","","0.047","","","","","2.742","2.742","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204179","11.969","0.002","12.06","0.002","11.166","0.002","73.67","0.01","84.16","0.01","59.91","0.008","1336.8","0.4","298","","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C30 H19 N4 O1.5 S4 -","- C30 H15 N4 O1.5 S4 -","- C60 H30 N8 O3 S8 -","2","1","","Sekizaki, Shuichi; Tada, Chiyoko; Yamochi, Hideki; Saito, Gunzi","Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA‒; R = Me, Et, Prn, Bun)","Journal of Materials Chemistry","2001","11","9","2293","","10.1039/b105340j","","","0.71073","MoK-alpha","","","0.083","","","0.08","","","","","1.767","1.767","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204180","7.814","0.001","8.649","0.002","14.448","0.002","105.06","0.01","91.61","0.01","116.51","0.01","832","0.3","298","","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C36 H18 N8 O2 S4 -","- C36 H18 N8 O2 S4 -","- C36 H18 N8 O2 S4 -","1","0.5","","Sekizaki, Shuichi; Tada, Chiyoko; Yamochi, Hideki; Saito, Gunzi","Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA‒; R = Me, Et, Prn, Bun)","Journal of Materials Chemistry","2001","11","9","2293","","10.1039/b105340j","","","0.71073","MoK-alpha","","","0.049","","","0.049","","","","","0.65","0.65","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204181","7.915","0.002","8.923","0.004","14.943","0.004","108.34","0.02","90.04","0.02","117.84","0.02","872","0.6","298","","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C38 H22 N8 O2 S4 -","- C38 H22 N8 O2 S4 -","- C38 H22 N8 O2 S4 -","1","0.5","","Sekizaki, Shuichi; Tada, Chiyoko; Yamochi, Hideki; Saito, Gunzi","Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA‒; R = Me, Et, Prn, Bun)","Journal of Materials Chemistry","2001","11","9","2293","","10.1039/b105340j","","","0.71073","MoK-alpha","","","0.05","","","0.052","","","","","0.822","0.822","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204182","10.357","0.003","12.243","0.008","14.085","0.009","74.74","0.05","69.26","0.04","73.11","0.04","1572.3","1.6","298","","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C74 H38 N8 O2 S12 -","- C74 H38 N8 O2 S12 -","- C74 H38 N8 O2 S12 -","1","0.5","","Sekizaki, Shuichi; Tada, Chiyoko; Yamochi, Hideki; Saito, Gunzi","Structural aspects of a series of cation radical salts of tetrathiotetracene (TTT) with 2-alkoxy-1,1,3,3-tetracyanoallyl anions (RO-TCA‒; R = Me, Et, Prn, Bun)","Journal of Materials Chemistry","2001","11","9","2293","","10.1039/b105340j","","","0.71073","MoK-alpha","","","0.05","","","0.048","","","","","2.104","2.104","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204188","12.675","0.003","11.17","0.002","20.954","0.004","90","","99.638","0.003","90","","2924.8","1","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H27 N9 -","- C36 H27 N9 -","- C144 H108 N36 -","4","1","","Pang, Jun; Tao, Ye; Freiberg, Stephan; Yang, Xiao-Ping; D'Iorio, Marie; Wang, Suning","Syntheses, structures, and electroluminescence of new blue luminescent star-shaped compounds based on 1,3,5-triazine and 1,3,5-trisubstituted benzene","Journal of Materials Chemistry","2002","12","2","206","","10.1039/b105422h","","","0.71073","MoKα","","0.1602","0.0426","","","0.0693","0.0872","","","","","","0.772","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7204189","12.89","0.004","19.438","0.006","12.707","0.004","90","","116.38","0.006","90","","2852.3","1.5","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C33 H24 N12 -","- C33 H23 N12 -","- C132 H92 N48 -","4","1","","Pang, Jun; Tao, Ye; Freiberg, Stephan; Yang, Xiao-Ping; D'Iorio, Marie; Wang, Suning","Syntheses, structures, and electroluminescence of new blue luminescent star-shaped compounds based on 1,3,5-triazine and 1,3,5-trisubstituted benzene","Journal of Materials Chemistry","2002","12","2","206","","10.1039/b105422h","","","0.71073","MoKα","","0.4086","0.0723","","","0.1211","0.1696","","","","","","0.644","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7204198","22.9824","0.0005","7.6791","0.0003","6.6178","0.0003","90","","90","","90","","1167.94","0.07","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C1.5 N O4.5 P Zn -","- C1.5 N O4.5 P Zn -","- C12 N8 O36 P8 Zn8 -","8","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of two-dimensional layered zinc phosphates to three-dimensional and one-dimensional structures","Journal of Materials Chemistry","2002","12","4","1044","","10.1039/b105899c","","","0.71073","MoKα","","0.0772","0.0564","","0.1285","0.1188","","","","1.23","1.29","1.29","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204204","9.5009","0.0006","13.9016","0.0009","14.6728","0.001","66.442","0.002","81.618","0.002","81.938","0.002","1750.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H18 N4 O -","- C20 H18 N4 O -","- C80 H72 N16 O4 -","4","2","","Chen, Yu; Harrison, William T. A.; Imrie, Corrie T.; Ryder, Karl S.","Pyrrole and polypyrrole-based liquid crystals containing azobenzene mesogenic groups","Journal of Materials Chemistry","2002","12","3","579","","10.1039/b105976a","","","0.6923","synchrotron","","0.1","0.079","","","0.24","0.258","","","","","","1.11","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7204205","11.8709","0.0018","7.6449","0.0012","20.891","0.004","90","","111.696","0.003","90","","1761.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 N4 O3 -","- C19 H18 N4 O3 -","- C76 H72 N16 O12 -","4","1","","Chen, Yu; Harrison, William T. A.; Imrie, Corrie T.; Ryder, Karl S.","Pyrrole and polypyrrole-based liquid crystals containing azobenzene mesogenic groups","Journal of Materials Chemistry","2002","12","3","579","","10.1039/b105976a","","","0.6923","synchrotron","","0.117","0.068","","","0.18","0.198","","","","","","0.88","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7204206","16.8349","0.0003","9.6773","0.0002","32.7691","0.0006","90","","90","","90","","5338.62","0.18","150","2","150","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C16 H38 Al10 F2 N4 O40 P10 -","- C16 H38 Al10 F2 N4 O40 P10 -","- C64 H152 Al40 F8 N16 O160 P40 -","4","1","","Wheatley, Paul S.; Love, Christopher J.; Morrison, John J.; Shannon, Ian J.; Morris, Russell E.","Synthesis of two new aluminophosphate based layered materials using Tet-A as a structure-directing agent","Journal of Materials Chemistry","2002","12","3","477","","10.1039/b106005h","","","0.6887","MonochromatedX-raysynchrotronradiation","","0.1262","0.1035","","","0.2858","0.2959","","","","","","1.029","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204207","9.4614","0.0008","11.7168","0.001","13.6647","0.0012","85.372","0.002","75.818","0.002","89.362","0.002","1463.8","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H80 Al4 Co N8 O26 P6 -","- C32 H76 Al4 Co N8 O26 P6 -","- C32 H76 Al4 Co N8 O26 P6 -","1","0.5","","Wheatley, Paul S.; Love, Christopher J.; Morrison, John J.; Shannon, Ian J.; Morris, Russell E.","Synthesis of two new aluminophosphate based layered materials using Tet-A as a structure-directing agent","Journal of Materials Chemistry","2002","12","3","477","","10.1039/b106005h","","","0.6892","MonochromatedX-raysynchrotronradiation","","0.0969","0.0878","","","0.2397","0.2518","","","","","","1.088","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204208","7.76","0.008","8.89","0.005","12.325","0.004","73.95","0.04","113.47","0.05","87.31","0.06","737.5","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 O8 Re2 S12 -","- C20 H16 O8 Re2 S12 -","- C20 H16 O8 Re2 S12 -","1","0.5","","Khasanov, Salavat S.; Pérez-Benítez, Aarón; Narymbetov, Bakhyt Zh.; Zorina, Leokadiya V.; Shibaeva, Rimma P.; Singleton, John; Klehe, Anne-Katrin; Laukhin, Vladimir N.; Vidal-Gancedo, José; Veciana, Jaume; Canadell, Enric; Rovira, Concepció","Interesting transport and magnetic properties in a new family of molecular materials based on the organic donor BET-TTF and the perrhenate anionElectronic supplementary information (ESI) available: overlap modes of the radical cations of 1‒3. See http://www.rsc.org/suppdata/jm/b1/b106070h/","Journal of Materials Chemistry","2002","12","3","432","","10.1039/b106070h","","","0.71073","MoKα","","0.0691","0.0653","","","0.1928","0.1979","","","","","","1.008","","","","has coordinates,has disorder","180373","2020-10-21","18:00:00",""
"7204209","6.37","0.002","7.788","0.004","22.865","0.005","84.6","0.03","89.5","0.02","70.25","0.03","1062.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H24 O8 Re2 S18 -","- C30 H24 O8 Re2 S18 -","- C30 H24 O8 Re2 S18 -","1","0.5","","Khasanov, Salavat S.; Pérez-Benítez, Aarón; Narymbetov, Bakhyt Zh.; Zorina, Leokadiya V.; Shibaeva, Rimma P.; Singleton, John; Klehe, Anne-Katrin; Laukhin, Vladimir N.; Vidal-Gancedo, José; Veciana, Jaume; Canadell, Enric; Rovira, Concepció","Interesting transport and magnetic properties in a new family of molecular materials based on the organic donor BET-TTF and the perrhenate anionElectronic supplementary information (ESI) available: overlap modes of the radical cations of 1‒3. See http://www.rsc.org/suppdata/jm/b1/b106070h/","Journal of Materials Chemistry","2002","12","3","432","","10.1039/b106070h","","","0.71073","MoKα","","0.0848","0.0721","","","0.1464","0.1533","","","","","","1.086","","","","has coordinates,has disorder","180373","2020-10-21","18:00:00",""
"7204210","10.993","0.003","19.292","0.004","17.713","0.004","120.96","0.02","89.76","0.03","91.88","0.03","3219.2","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C98 H88 O18 Re4 S54 -","- C98 H88 O18 Re4 S54 -","- C98 H88 O18 Re4 S54 -","1","0.5","","Khasanov, Salavat S.; Pérez-Benítez, Aarón; Narymbetov, Bakhyt Zh.; Zorina, Leokadiya V.; Shibaeva, Rimma P.; Singleton, John; Klehe, Anne-Katrin; Laukhin, Vladimir N.; Vidal-Gancedo, José; Veciana, Jaume; Canadell, Enric; Rovira, Concepció","Interesting transport and magnetic properties in a new family of molecular materials based on the organic donor BET-TTF and the perrhenate anionElectronic supplementary information (ESI) available: overlap modes of the radical cations of 1‒3. See http://www.rsc.org/suppdata/jm/b1/b106070h/","Journal of Materials Chemistry","2002","12","3","432","","10.1039/b106070h","","","0.71073","MoKα","","0.0629","0.061","","","0.1211","0.1223","","","","","","1.098","","","","has coordinates,has disorder","180373","2020-10-21","18:00:00",""
"7204217","9.203","0.001","15.776","0.002","31.587","0.004","90","","90","","90","","4586","1","293","","293","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Bis-tetramethylammonium-tri-zinc-tetra-hydrogenphosphate","","- C8 H28 N2 O16 P4 Zn3 -","- C8 H28 N2 O16 P4 Zn3 -","- C64 H224 N16 O128 P32 Zn24 -","8","0.25","","Wiebcke, Michael","[Zn3(HPO4)4](NMe4)2: a zincophosphate containing interruptions of isolated hydrogen-bonding [H‒O(P)]4 groupings within a novel three-dimensional four-connected framework","Journal of Materials Chemistry","2002","12","3","421","","10.1039/b106274n","","","0.71073","MoKα","","0.0939","0.0368","","","0.0729","0.0868","","","","","","1.02","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204223","12.38","0.003","12.38","0.003","14.558","0.005","90","","90","","120","","1932.3","0.9","298","2","298","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C H5 Be Co0.17 N0.67 O4.5 P -","- Be Co0.166667 N0.66 O4.5 P -","- Be18 Co3 N11.88 O81 P18 -","18","1","","Zhang, Haoyu; Weng, Linhong; Zhou, Yaming; Chen, Zhenxia; Sun, Jinyu; Zhao, Dongyuan","[C6N4H24]CoBe6P6O24·3H2O: a novel 3-dimensional beryllophosphate zeolite-like structure encapsulating CoII ions","Journal of Materials Chemistry","2002","12","3","658","","10.1039/b106643a","","","0.71073","MoKα","","0.0881","0.0878","","","0.1929","0.1931","","","","","","1.472","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204224","7.1353","0.0005","11.6238","0.0005","15.9011","0.0012","90","","90","","90","","1318.83","0.15","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Zn(PT)1.2(MTT)0.8(H2O)","(1-hydroxy-2(1H)-pyridinethiolato-S2,O) (3-hydroxy-4-methyl-2(3H)-thiazolethiolate-S2,O)zinc(II) hydrate","","- C9.2 H10 N2 O3 S2.8 Zn -","- C9.2 H10 N2 O3 S2.8 Zn -","- C36.8 H40 N8 O12 S11.2 Zn4 -","4","1","","Bond, Andrew D.; Benevelli, Francesca; Jones, William","Modification of the solid-state structure of bis(1-hydroxy-2(1H)-pyridinethiolato-S2,O)zinc(ii): synthesis and characterisation of a molecular solid solution incorporating 3-hydroxy-4-methyl-2(3H)-thiazolethioneElectronic supplementary information (ESI) available: lists of reflection indices and refined lattice parameters from the PXRD profiles of the single phase Zn(PT)x(MTT)2 ‒ x(H2O) products (Fig. 4). See http://www.rsc.org/suppdata/jm/b1/b106734f/","Journal of Materials Chemistry","2002","12","2","324","","10.1039/b106734f","","","0.71073","MoKα","","0.0305","0.0273","","","0.0553","0.0566","","","","","","1.088","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7204225","12.51","0.003","14.584","0.003","4.6243","0.0009","90","","90","","90","","843.7","0.3","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Eu5 In2 Sb6 -","- Eu5 In2 Sb6 -","- Eu10 In4 Sb12 -","2","0.25","","Park, Seon-Mi; Choi, Eun Sang; Kang, Woun; Kim, Sung-Jin","Eu5In2Sb6, Eu5In2‒xZnxSb6: rare earth zintl phases with narrow band gaps","Journal of Materials Chemistry","2002","12","6","1839","","10.1039/b106812a","","","0.71073","MoKα","","0.0544","0.035","","","0.1291","0.1439","","","","","","0.877","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204227","36.596","0.004","6.445","0.001","29.798","0.003","90","","118.1","0.01","90","","6199.8","1.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,4-bis[2-(4-tert-butylphenyl)-1,3,4-oxadiazol-5-yl]benzene toluene solvate","","- C37 H38 N4 O2 -","- C37 H38 N4 O2 -","- C296 H304 N32 O16 -","8","1","","Wang, Changsheng; Jung, Gun-Young; Batsanov, Andrei S.; Bryce, Martin R.; Petty, Michael C.","New electron-transporting materials for light emitting diodes: 1,3,4-oxadiazole‒pyridine and 1,3,4-oxadiazole‒pyrimidine hybrids","Journal of Materials Chemistry","2002","12","2","173","","10.1039/b106907c","","","0.71073","MoKα","","0.1507","0.0874","","","0.1759","0.2127","","","","","","1.098","","","","has coordinates,has disorder","180373","2020-10-21","18:00:00",""
"7204228","18.7544","0.0012","11.6181","0.0007","11.4838","0.0007","90","","90.221","0.004","90","","2502.2","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4-bis[2-(4-tert-butylphenyl)-1,3,4-oxadiazol-5-yl]pyridine","","- C29 H29 N5 O2 -","- C29 H29 N5 O2 -","- C116 H116 N20 O8 -","4","1","","Wang, Changsheng; Jung, Gun-Young; Batsanov, Andrei S.; Bryce, Martin R.; Petty, Michael C.","New electron-transporting materials for light emitting diodes: 1,3,4-oxadiazole‒pyridine and 1,3,4-oxadiazole‒pyrimidine hybrids","Journal of Materials Chemistry","2002","12","2","173","","10.1039/b106907c","","","0.71073","MoKα","","0.066","0.0465","","","0.1052","0.1176","","","","","","1.062","","","","has coordinates,has disorder","180373","2020-10-21","18:00:00",""
"7204237","19.006","0.004","16.679","0.003","20.788","0.004","90","","115.04","0.03","90","","5970","2","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H56 Mn2 N12 O0.5 S4 -","- C56 H55 Mn2 N12 O0.5 S4 -","- C224 H220 Mn8 N48 O2 S16 -","4","1","","Hou, Hongwei; Wei, Yongli; Song, Yinglin; Zhu, Yu; Li, Linke; Fan, Yaoting","Two novel two-dimensional double-sheet layered manganese(ii) coordination polymers: synthesis, crystal structures and third-order nonlinear optical properties","Journal of Materials Chemistry","2002","12","4","838","","10.1039/b107375n","","","0.71073","MoKα","","0.2047","0.0772","","0.1783","0.1412","","","","1.073","1.235","1.235","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204238","19.439","0.004","7.128","0.0014","21.489","0.004","90","","112.76","0.03","90","","2745.7","1.1","291","2","291","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 Mn N10 -","- C26 H28 Mn N10 -","- C104 H112 Mn4 N40 -","4","0.5","","Hou, Hongwei; Wei, Yongli; Song, Yinglin; Zhu, Yu; Li, Linke; Fan, Yaoting","Two novel two-dimensional double-sheet layered manganese(ii) coordination polymers: synthesis, crystal structures and third-order nonlinear optical properties","Journal of Materials Chemistry","2002","12","4","838","","10.1039/b107375n","","","0.71073","MoKα","","0.0979","0.0613","","","0.0813","0.0901","","","","","","1.097","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204257","5.1623","0.0007","5.388","0.001","7.073","0.001","106.68","0.01","107.4","0.01","97.5","0.01","174.72","0.05","","","","","","","","","","","","5","P -1","-P 1","2","","","","- F Li Mg O4 S -","- F Li Mg O4 S -","- F2 Li2 Mg2 O8 S2 -","2","1","","Sebastian, Litty; Gopalakrishnan, Jagannatha; Piffard, Yves","Synthesis, crystal structure and lithium ion conductivity of LiMgFSO4","Journal of Materials Chemistry","2002","12","2","374","","10.1039/b108289m","","x-ray","0.71073","MoKα","","0.1552","0.0523","","0.0565","0.0515","","","","1.74","1.29","1.29","","","","","has coordinates","201370","2020-10-21","18:00:00",""
"7204258","18.7573","0.0003","8.2803","0.0002","8.9225","0.0001","90","","106.815","0.001","90","","1326.56","0.04","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C H2 O7 P2 Zn2 -","- C H2 O7 P2 Zn2 -","- C8 H16 O56 P16 Zn16 -","8","1","","Barthelet, K.; Merlier, C.; Serre, C.; Riou-Cavellec, M.; Riou, D.; Férey, G.","Microporous hybrid compounds: hydrothermal synthesis and characterization of two zinciomethylenediphosphonates with 3D structures, structure determination of their dehydrated formsElectronic supplementary information (ESI): final Rietveld plots for MIL-48calc and VSB-4(Zn). See http://www.rsc.org/suppdata/jm/b1/b108301p","Journal of Materials Chemistry","2002","12","4","1132","","10.1039/b108301p","","","0.71073","MoKα","","0.0294","0.0269","","0.0719","0.0704","","","","1.056","1.08","1.08","","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204259","8.9929","0.0009","5.5093","0.0006","18.025","0.002","90","","92.376","0.002","90","","892.27","0.16","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C H2 Na O8.5 P2 Zn2 -","- C H2 Na O8.5 P2 Zn2 -","- C4 H8 Na4 O34 P8 Zn8 -","4","1","","Barthelet, K.; Merlier, C.; Serre, C.; Riou-Cavellec, M.; Riou, D.; Férey, G.","Microporous hybrid compounds: hydrothermal synthesis and characterization of two zinciomethylenediphosphonates with 3D structures, structure determination of their dehydrated formsElectronic supplementary information (ESI): final Rietveld plots for MIL-48calc and VSB-4(Zn). See http://www.rsc.org/suppdata/jm/b1/b108301p","Journal of Materials Chemistry","2002","12","4","1132","","10.1039/b108301p","","","0.71073","MoKα","","0.162","0.07","","0.1379","0.1078","","","","1.057","1.145","1.145","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204272","20.6948","0.0007","8.789","0.0003","7.7472","0.0003","90","","90","","90","","1409.11","0.09","293","2","293","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- C14 H10 S5 -","- C14 H10 S5 -","- C56 H40 S20 -","4","0.5","","Pozo-Gonzalo, Cristina; Khan, Tahir; McDouall, Joseph J. W.; Skabara, Peter J.; Roberts, Donna M.; Light, Mark E.; Coles, Simon J.; Hursthouse, Michael B.; Neugebauer, Helmut; Cravino, Antonio; Sariciftci, N. Serdar","Synthesis and electropolymerisation of 3',4'-bis(alkylsulfanyl)terthiophenes and the significance of the fused dithiin ring in 2,5-dithienyl-3,4-ethylenedithiothiophene (DT-EDTT)","Journal of Materials Chemistry","2002","12","3","500","","10.1039/b109017h","","","0.71073","MoKα","","0.0231","0.0224","","","0.0579","0.0583","","","","","","1.047","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204273","15.721","0.003","8.8601","0.0018","21.597","0.004","90","","90","","90","","3008.2","1","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C15 H12 S5 -","- C15 H12 S5 -","- C120 H96 S40 -","8","1","","Pozo-Gonzalo, Cristina; Khan, Tahir; McDouall, Joseph J. W.; Skabara, Peter J.; Roberts, Donna M.; Light, Mark E.; Coles, Simon J.; Hursthouse, Michael B.; Neugebauer, Helmut; Cravino, Antonio; Sariciftci, N. Serdar","Synthesis and electropolymerisation of 3',4'-bis(alkylsulfanyl)terthiophenes and the significance of the fused dithiin ring in 2,5-dithienyl-3,4-ethylenedithiothiophene (DT-EDTT)","Journal of Materials Chemistry","2002","12","3","500","","10.1039/b109017h","","","0.71073","MoKα","","0.0508","0.0337","","","0.0768","0.0854","","","","","","1.022","","","","has coordinates,has disorder","180373","2020-10-21","18:00:00",""
"7204277","11.746","0.004","11.892","0.003","20.568","0.007","90","","90","","90","","2873","1.6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C17 H14 Br2 -","- C17 H14 Br2 -","- C136 H112 Br16 -","8","1","","Destri, Silvia; Pasini, Mariacecilia; Botta, Chiara; Porzio, William; Bertini, Fabio; Marchiò, Luciano","Synthesis and crystal structure and optical properties of fluorenic-core oligomers","Journal of Materials Chemistry","2002","12","4","924","","10.1039/b109089p","","","1.54184","CuKα","","0.0704","0.0325","","","0.0651","0.0758","","","","","","0.837","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204278","16.563","0.001","16.563","0.001","20.657","0.001","90","","90","","90","","5666.9","0.6","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C33 H38 S2 -","- C33 H38 S2 -","- C264 H304 S16 -","8","0.5","","Destri, Silvia; Pasini, Mariacecilia; Botta, Chiara; Porzio, William; Bertini, Fabio; Marchiò, Luciano","Synthesis and crystal structure and optical properties of fluorenic-core oligomers","Journal of Materials Chemistry","2002","12","4","924","","10.1039/b109089p","","","0.71073","MoKα","","0.0786","0.041","","","0.0914","0.0944","","","","","","0.728","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204279","12.666","0.004","21.383","0.009","7.351","0.001","90","","90","","90","","1990.9","1.1","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C25 H20 S2 -","- C25.06 H17 S1.933 -","- C100.24 H68 S7.732 -","4","1","","Destri, Silvia; Pasini, Mariacecilia; Botta, Chiara; Porzio, William; Bertini, Fabio; Marchiò, Luciano","Synthesis and crystal structure and optical properties of fluorenic-core oligomers","Journal of Materials Chemistry","2002","12","4","924","","10.1039/b109089p","","","0.71073","MoKα","","0.1655","0.0609","","0.1924","","0.1607","","","1.146","1.376","1.376","","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204280","12.192","0.008","7.217","0.003","13.224","0.006","90","","117.23","0.05","90","","1034.6","1","293","2","293","2","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C29 H24 -","- C29 H24 -","- C58 H48 -","2","1","","Destri, Silvia; Pasini, Mariacecilia; Botta, Chiara; Porzio, William; Bertini, Fabio; Marchiò, Luciano","Synthesis and crystal structure and optical properties of fluorenic-core oligomers","Journal of Materials Chemistry","2002","12","4","924","","10.1039/b109089p","","","0.71073","MoKα","","0.165","0.0618","","0.1664","0.1208","","","","1.008","1.149","1.149","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204282","16.7057","0.0004","7.7137","0.0002","18.8324","0.0005","90","","114.524","0.001","90","","2207.87","0.1","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H2 F6 N2 O10 Os3 -","- C15 H2 F6 N2 O10 Os3 -","- C60 H8 F24 N8 O40 Os12 -","4","1","","Chi, Yun; Yu, Huan-Li; Ching, Wei-Li; Liu, Chao-Shiuan; Chen, Yao-Lun; Chou, Tsung-Yi; Peng, Shie-Ming; Lee, Gene-Hsiang","Deposition of osmium thin films using pyrazolate complexes as CVD source reagents","Journal of Materials Chemistry","2002","12","5","1363","","10.1039/b109150f","","","0.71073","MoKα","","0.0385","0.0297","","","0.079","0.0882","","","","","","1.086","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204283","11.9181","0.0002","11.9181","0.0002","8.2009","0.0002","90","","90","","90","","1164.86","0.04","295","2","295","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C16 H2 F12 N4 O6 Os2 -","- C16 H2 F12 N4 O6 Os2 -","- C32 H4 F24 N8 O12 Os4 -","2","0.25","","Chi, Yun; Yu, Huan-Li; Ching, Wei-Li; Liu, Chao-Shiuan; Chen, Yao-Lun; Chou, Tsung-Yi; Peng, Shie-Ming; Lee, Gene-Hsiang","Deposition of osmium thin films using pyrazolate complexes as CVD source reagents","Journal of Materials Chemistry","2002","12","5","1363","","10.1039/b109150f","","","0.71073","MoKα","","0.0157","0.0146","","","0.0363","0.0365","","","","","","1.094","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204289","25.255","0.005","7.084","0.0012","8.26","0.0017","90","","98.639","0.013","90","","1461","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","H2TCNDQ","dihydro-tetracyanoquinodiphenoquinodimethane","","- C18 H10 N4 -","- C18 H10 N4 -","- C72 H40 N16 -","4","0.5","","Nishimura, Kazukuni; Khasanov, Salavat S.; Saito, Gunzi","Charge transfer, proton transfer and clathrate compounds of dihydrotetracyanodiphenoquinodimethane (H2TCNDQ) having highly acidic protonsElectronic supplementary information (ESI) available: elemental analysis results for H2TCNDQ complexes. See http://www.rsc.org/suppdata/jm/b1/b109503j/","Journal of Materials Chemistry","2002","12","6","1693","","10.1039/b109503j","","","0.71073","MoKα","","0.0873","0.0589","","","0.1421","0.1591","","","","","","1.105","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204290","5.4345","0.0007","8.718","0.001","14.358","0.001","79.531","0.008","88.09","0.009","84.89","0.01","666.17","0.13","","","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H18 N4 O4 S4 -","- C28 H18 N4 O4 S4 -","- C28 H18 N4 O4 S4 -","1","0.5","","Nishimura, Kazukuni; Khasanov, Salavat S.; Saito, Gunzi","Charge transfer, proton transfer and clathrate compounds of dihydrotetracyanodiphenoquinodimethane (H2TCNDQ) having highly acidic protonsElectronic supplementary information (ESI) available: elemental analysis results for H2TCNDQ complexes. See http://www.rsc.org/suppdata/jm/b1/b109503j/","Journal of Materials Chemistry","2002","12","6","1693","","10.1039/b109503j","","","0.71073","MoK-alpha","","","0.038","","","0.038","","","","","0.488","0.488","","","","","has coordinates","295880","2024-11-12","08:14:39",""
"7204291","5.485","0.0005","9.056","0.001","14.437","0.0016","80.614","0.006","87.995","0.006","84.202","0.006","703.77","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(EOET)(H2TCNDQ)","","","- C28 H18 N4 O2 S6 -","- C28 H18 N4 O2 S6 -","- C28 H18 N4 O2 S6 -","1","0.5","","Nishimura, Kazukuni; Khasanov, Salavat S.; Saito, Gunzi","Charge transfer, proton transfer and clathrate compounds of dihydrotetracyanodiphenoquinodimethane (H2TCNDQ) having highly acidic protonsElectronic supplementary information (ESI) available: elemental analysis results for H2TCNDQ complexes. See http://www.rsc.org/suppdata/jm/b1/b109503j/","Journal of Materials Chemistry","2002","12","6","1693","","10.1039/b109503j","","","0.71073","MoKα","","0.0714","0.0593","","","0.1527","0.1624","","","","","","1.045","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204292","6.65","0.004","11.626","0.002","14.366","0.003","108.72","0.01","91.7","0.03","105.8","0.03","1003.8","0.7","","","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H13 N2 S4 -","- C23 H13 N2 S4 -","- C46 H26 N4 S8 -","2","1","","Nishimura, Kazukuni; Khasanov, Salavat S.; Saito, Gunzi","Charge transfer, proton transfer and clathrate compounds of dihydrotetracyanodiphenoquinodimethane (H2TCNDQ) having highly acidic protonsElectronic supplementary information (ESI) available: elemental analysis results for H2TCNDQ complexes. See http://www.rsc.org/suppdata/jm/b1/b109503j/","Journal of Materials Chemistry","2002","12","6","1693","","10.1039/b109503j","","","0.71073","MoK-alpha","","","0.041","","","0.045","","","","","0.746","0.746","","","","","has coordinates","295880","2024-11-12","08:14:39",""
"7204293","14.208","0.0017","16.706","0.002","21.054","0.0009","90","","90","","90","","4997.4","0.9","293","2","293","2","","","","","","","","3","P 21 2 21","P 2ac 2ac","18","(H-DAD+)2(TCNDQ2-)","","","- C38 H42 N8 -","- C38 H41.96 N8 -","- C228 H251.76 N48 -","6","1.5","","Nishimura, Kazukuni; Khasanov, Salavat S.; Saito, Gunzi","Charge transfer, proton transfer and clathrate compounds of dihydrotetracyanodiphenoquinodimethane (H2TCNDQ) having highly acidic protonsElectronic supplementary information (ESI) available: elemental analysis results for H2TCNDQ complexes. See http://www.rsc.org/suppdata/jm/b1/b109503j/","Journal of Materials Chemistry","2002","12","6","1693","","10.1039/b109503j","","","0.71073","MoKα","","0.1048","0.088","","","0.2483","0.2746","","","","","","1.128","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204294","7.52","0.0018","10.638","0.002","14.505","0.003","111.515","0.011","97.681","0.013","92.765","0.01","1063.9","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","(3,3,5,5-TMB)(H2TCNDQ)2","","","- C52 H40 N10 -","- C52 H40 N10 -","- C52 H40 N10 -","1","0.5","","Nishimura, Kazukuni; Khasanov, Salavat S.; Saito, Gunzi","Charge transfer, proton transfer and clathrate compounds of dihydrotetracyanodiphenoquinodimethane (H2TCNDQ) having highly acidic protonsElectronic supplementary information (ESI) available: elemental analysis results for H2TCNDQ complexes. See http://www.rsc.org/suppdata/jm/b1/b109503j/","Journal of Materials Chemistry","2002","12","6","1693","","10.1039/b109503j","","","0.71073","MoKα","","0.0739","0.0542","","","0.1338","0.1476","","","","","","1.023","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204295","7.073","0.0012","7.338","0.0009","12.674","0.003","74.474","0.011","89.585","0.01","65.92","0.01","574.74","0.19","293","2","293","2","","","","","","","","3","P -1","-P 1","2","(phenazine)(H2TCNDQ)","","","- C30 H18 N6 -","- C30 H18 N6 -","- C30 H18 N6 -","1","0.5","","Nishimura, Kazukuni; Khasanov, Salavat S.; Saito, Gunzi","Charge transfer, proton transfer and clathrate compounds of dihydrotetracyanodiphenoquinodimethane (H2TCNDQ) having highly acidic protonsElectronic supplementary information (ESI) available: elemental analysis results for H2TCNDQ complexes. See http://www.rsc.org/suppdata/jm/b1/b109503j/","Journal of Materials Chemistry","2002","12","6","1693","","10.1039/b109503j","","","0.71073","MoKα","","0.0969","0.0568","","","0.125","0.148","","","","","","1.057","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7204305","12.7718","0.0007","13.6139","0.0007","8.2466","0.0004","90","","119.259","0.001","90","","1250.93","0.11","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- H4.2 Na2 O14.1 Si4 U -","- Na2 O14.1 Si4 U -","- Na8 O56.4 Si16 U4 -","4","0.5","","Wang, Xiqu; Huang, Jin; Liu, Lumei; Jacobson, Allan J.","The novel open-framework uranium silicates Na2(UO2)(Si4O10)·2.1H2O (USH-1) and RbNa(UO2)(Si2O6)·H2O (USH-3)","Journal of Materials Chemistry","2002","12","3","406","","10.1039/b109878k","","","0.71073","MoKα","","0.0493","0.0456","","","0.1292","0.1339","","","","","","1.064","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204306","7.3668","0.0005","7.8691","0.0006","8.1766","0.0006","78.024","0.001","75.013","0.001","83.741","0.001","447.14","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- H2 Na O9 Rb Si2 U -","- Na O9 Rb Si2 U -","- Na2 O18 Rb2 Si4 U2 -","2","1","","Wang, Xiqu; Huang, Jin; Liu, Lumei; Jacobson, Allan J.","The novel open-framework uranium silicates Na2(UO2)(Si4O10)·2.1H2O (USH-1) and RbNa(UO2)(Si2O6)·H2O (USH-3)","Journal of Materials Chemistry","2002","12","3","406","","10.1039/b109878k","","","0.71073","MoKα","","0.0485","0.0469","","","0.1374","0.1391","","","","","","1.143","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204312","13.373","0.007","5.3282","0.0011","8.926","0.004","90","0.02","100.65","0.04","90","0.02","625.1","0.5","110","","110","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- K1.33 O32 P4 W8 -","- K1.30688 O32 P4 W8 -","- K1.30688 O32 P4 W8 -","1","0.5","","Dusek, Michal; Lüdecke, Jens; van Smaalen, Sander","Crystal structure of monophosphate tungsten bronze K1.33P4W8O32 at 110 K","Journal of Materials Chemistry","2002","12","5","1408","","10.1039/b109982p","","x-ray","0.59","synchrotron","","0.0507","0.0283","","","0.053","0.0597","","","","2.48","2.48","2.19","","","","has coordinates","190383","2020-10-21","18:00:00",""
"7204313","10.297","0.0012","10.7861","0.0012","21.258","0.002","90","","90","","90","","2361","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H40 O6 Zr -","- C18 H40 O6 Zr -","- C72 H160 O24 Zr4 -","4","1","","Williams, Paul A.; Roberts, John L.; Jones, Anthony C.; Chalker, Paul R.; Bickley, Jamie F.; Steiner, Alexander; Davies, Hywel O.; Leedham, Timothy J.","Novel mononuclear zirconium and hafnium alkoxides; improved precursors for the MOCVD of ZrO2 and HfO2","Journal of Materials Chemistry","2002","12","2","165","","10.1039/b109994a","","","0.71073","MoKα","","0.0452","0.0389","","","0.099","0.103","","","","","","0.728","","","","has coordinates,has disorder","180374","2020-10-21","18:00:00",""
"7204314","10.1972","0.0008","10.7413","0.0008","21.3221","0.0017","90","","90","","90","","2335.4","0.3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H40 Hf O6 -","- C18 H40 Hf O6 -","- C72 H160 Hf4 O24 -","4","1","","Williams, Paul A.; Roberts, John L.; Jones, Anthony C.; Chalker, Paul R.; Bickley, Jamie F.; Steiner, Alexander; Davies, Hywel O.; Leedham, Timothy J.","Novel mononuclear zirconium and hafnium alkoxides; improved precursors for the MOCVD of ZrO2 and HfO2","Journal of Materials Chemistry","2002","12","2","165","","10.1039/b109994a","","","0.71073","MoKα","","0.0254","0.0247","","","0.0606","0.0609","","","","","","1.077","","","","has coordinates,has disorder","180374","2020-10-21","18:00:00",""
"7204321","10.9493","0.0005","10.9493","0.0005","26.7099","0.0013","90","","90","","120","","2773.2","0.2","298","2","298","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","Sodium zinc arsenate","","","- As3 H12 Na3 O19 Zn4 -","- As3 H12 Na3 O19 Zn4 -","- As18 H72 Na18 O114 Zn24 -","6","0.333333","","Yeates, Rachel M.; Harrison, William T. A.","Synthesis, crystal structure and properties of Na3Zn4O(AsO4)3·6H2O, a new framework zincoarsenate","Journal of Materials Chemistry","2002","12","4","1103","","10.1039/b110288e","","","0.71073","MoKα","","0.0239","0.0211","","","0.0419","0.0423","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204322","4.274","0.004","11.114","0.003","37.426","0.004","90","","90","","90","","1777.8","1.7","293.2","","","","","","","","","","","7","P n n m","-P 2 2n","58","","","","- C20 H8 Au I4 N4 S8 Se4 -","- C20 H8 Au I4 N4 S8 Se4 -","- C40 H16 Au2 I8 N8 S16 Se8 -","2","0.25","","Imakubo, Tatsuro; Tajima, Naoya; Tamura, Masafumi; Kato, Reizo; Nishio, Yutaka; Kajita, Koji","A supramolecular superconductor θ-(DIETS)2[Au(CN)4]","Journal of Materials Chemistry","2002","12","2","159","","10.1039/b110303b","","","0.7107","MoKα","","","0","","","","0.0415","","","","","","1.167","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204326","7.213","0.003","19.856","0.005","4.041","0.0009","92.08","0.01","89.61","0.02","95.59","0.01","575.6","0.3","295","2","","","","","","","","","Local laboratory","5","P 1","P 1","1","","","","- C22 H12 N4 O2 S6 -","- C22 H12 N4 O2 S6 -","- C22 H12 N4 O2 S6 -","1","1","","Saito, Gunzi; Sasaki, Hiroshi; Aoki, Takashi; Yoshida, Yukihiro; Otsuka, Akihiro; Yamochi, Hideki; Drozdova, Olga O.; Yakushi, Kyuya; Kitagawa, Hiroshi; Mitani, Tadaoki","Complex formation of ethylenedioxyethylenedithiotetrathiafulvalene (EDOEDT-TTF: EOET) and its self-assembling ability","Journal of Materials Chemistry","2002","12","6","1640","","10.1039/b110605h","","","0.71073","MoK-alpha","","","0.057","","","0.134","","","","","1.071","1.071","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204327","9.887","0.004","12.024","0.004","9.387","0.004","94.75","0.03","109.87","0.04","103.17","0.03","1006.1","0.8","295","2","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","?","- C34 H24 N4 O6 S12 -","- C34 H24 N4 O6 S12 -","1","0.5","","Saito, Gunzi; Sasaki, Hiroshi; Aoki, Takashi; Yoshida, Yukihiro; Otsuka, Akihiro; Yamochi, Hideki; Drozdova, Olga O.; Yakushi, Kyuya; Kitagawa, Hiroshi; Mitani, Tadaoki","Complex formation of ethylenedioxyethylenedithiotetrathiafulvalene (EDOEDT-TTF: EOET) and its self-assembling ability","Journal of Materials Chemistry","2002","12","6","1640","","10.1039/b110605h","","","0.71073","MoK-alpha","","","0.055","","","0.064","","","","","1.276","1.276","","","","","has coordinates","180374","2020-10-21","18:00:00",""
"7204328","7.62","0.0006","12.973","0.002","13.247","0.002","90","","91.316","0.008","90","","1309.2","0.3","295","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H8 N8 O2 S8 -","- C22 N8 O2 S8 -","- C44 N16 O4 S16 -","2","0.5","","Saito, Gunzi; Sasaki, Hiroshi; Aoki, Takashi; Yoshida, Yukihiro; Otsuka, Akihiro; Yamochi, Hideki; Drozdova, Olga O.; Yakushi, Kyuya; Kitagawa, Hiroshi; Mitani, Tadaoki","Complex formation of ethylenedioxyethylenedithiotetrathiafulvalene (EDOEDT-TTF: EOET) and its self-assembling ability","Journal of Materials Chemistry","2002","12","6","1640","","10.1039/b110605h","","","0.71073","MoKα","","0.0699","0.0699","","0.1707","0.1707","","","","1.209","1.209","1.209","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204329","7.541","0.001","9.169","0.0008","15.216","0.002","93.948","0.007","101.68","0.006","106.924","0.008","976.5","0.2","295","2","","","","","","","","","Local laboratory","4","P 1","P 1","1","","","","?","- C34 N16 O2 S10 -","- C34 N16 O2 S10 -","1","1","","Saito, Gunzi; Sasaki, Hiroshi; Aoki, Takashi; Yoshida, Yukihiro; Otsuka, Akihiro; Yamochi, Hideki; Drozdova, Olga O.; Yakushi, Kyuya; Kitagawa, Hiroshi; Mitani, Tadaoki","Complex formation of ethylenedioxyethylenedithiotetrathiafulvalene (EDOEDT-TTF: EOET) and its self-assembling ability","Journal of Materials Chemistry","2002","12","6","1640","","10.1039/b110605h","","","0.71073","MoK-alpha","","","0.063","","","0.161","","","","","1.264","1.264","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204330","8.12","0.0005","12","0.0009","10.967","0.0005","69.558","0.004","108.343","0.004","104.786","0.004","937.68","0.11","295","2","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C26 H16 I4 O6 S12 -","- C26 H16 I4 O6 S12 -","- C26 H16 I4 O6 S12 -","1","0.5","","Saito, Gunzi; Sasaki, Hiroshi; Aoki, Takashi; Yoshida, Yukihiro; Otsuka, Akihiro; Yamochi, Hideki; Drozdova, Olga O.; Yakushi, Kyuya; Kitagawa, Hiroshi; Mitani, Tadaoki","Complex formation of ethylenedioxyethylenedithiotetrathiafulvalene (EDOEDT-TTF: EOET) and its self-assembling ability","Journal of Materials Chemistry","2002","12","6","1640","","10.1039/b110605h","","","0.71073","MoK-alpha","","","0.033","","","0.099","","","","","1.029","1.029","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204336","11.243","0.002","8.113","0.001","20.822","0.004","90","","101.537","0.003","90","","1860.9","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-β-(N-propyl-2-benzothiazolium) -α-cyano-4-(2,3,5,6-tetrafluoro)styryldicyanomethanide","","- C22 H12 F4 N4 S -","- C22 H12 F4 N4 S -","- C88 H48 F16 N16 S4 -","4","1","","Norman A. Bell; David J. Crouch; Derek J. Simmonds; Andres E. Goeta; Thomas Gelbrich; Michael B. Hursthouse","Structural and solvatochromic studies of a series of tricyanoquinodimethane-based zwitterions","J. Mater. Chem.","2002","12","5","1274","1279","10.1039/b111392p","","","0.71073","MoKα","","0.0436","0.033","","","0.0788","0.0853","","","","","","1.086","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204337","8.0663","0.0003","9.4561","0.0002","12.8115","0.0005","83.317","0.002","81.489","0.001","89.601","0.002","959.83","0.06","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","(Z)-β-(N-butyl-2-benzoselenozolium) -α-cyano-4-styryldicyanomethanide","","- C23 H18 N4 Se -","- C23 H18 N4 Se -","- C46 H36 N8 Se2 -","2","1","","Norman A. Bell; David J. Crouch; Derek J. Simmonds; Andres E. Goeta; Thomas Gelbrich; Michael B. Hursthouse","Structural and solvatochromic studies of a series of tricyanoquinodimethane-based zwitterions","J. Mater. Chem.","2002","12","5","1274","1279","10.1039/b111392p","","","0.71073","MoKα","","0.0629","0.0401","","","0.0732","0.0784","","","","","","0.996","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204338","5.9096","0.0002","5.90965","","14.6101","0.0003","90","","90","","120","","441.879","0.017","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba3 Gd O9 Ru2 -","- Ba3 Gd O9 Ru2 -","- Ba6 Gd2 O18 Ru4 -","2","0.0833333","","Doi, Yoshihiro; Hinatsu, Yukio","Magnetic and calorimetric studies on Ba3LnRu2O9 (Ln = Gd, Ho–Yb) with 6H-perovskite structure","Journal of Materials Chemistry","2002","12","6","1792","","10.1039/b111504a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","288318","2023-12-14","17:14:09",""
"7204339","5.8763","0.0002","5.87635","","14.4794","0.0004","90","","90","","120","","433.005","0.019","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba3 Er O9 Ru2 -","- Ba3 Er O9 Ru2 -","- Ba6 Er2 O18 Ru4 -","2","0.0833333","","Doi, Yoshihiro; Hinatsu, Yukio","Magnetic and calorimetric studies on Ba3LnRu2O9 (Ln = Gd, Ho–Yb) with 6H-perovskite structure","Journal of Materials Chemistry","2002","12","6","1792","","10.1039/b111504a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","288318","2023-12-14","17:14:09",""
"7204340","5.8838","0.0002","5.8838","","14.5064","0.0005","90","","90","","120","","434.92","0.02","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba3 Ho O9 Ru2 -","- Ba3 Ho O9 Ru2 -","- Ba6 Ho2 O18 Ru4 -","2","0.0833333","","Doi, Yoshihiro; Hinatsu, Yukio","Magnetic and calorimetric studies on Ba3LnRu2O9 (Ln = Gd, Ho–Yb) with 6H-perovskite structure","Journal of Materials Chemistry","2002","12","6","1792","","10.1039/b111504a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","288318","2023-12-14","17:14:09",""
"7204341","5.8686","0.0002","5.86862","","14.4537","0.0004","90","","90","","120","","431.102","0.019","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba3 O9 Ru2 Tm -","- Ba3 O9 Ru2 Tm -","- Ba6 O18 Ru4 Tm2 -","2","0.0833333","","Doi, Yoshihiro; Hinatsu, Yukio","Magnetic and calorimetric studies on Ba3LnRu2O9 (Ln = Gd, Ho–Yb) with 6H-perovskite structure","Journal of Materials Chemistry","2002","12","6","1792","","10.1039/b111504a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","288318","2023-12-14","17:14:09",""
"7204342","5.8616","0.0002","5.86161","","14.4321","0.0004","90","","90","","120","","429.431","0.019","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba3 O9 Ru2 Yb -","- Ba3 O9 Ru2 Yb -","- Ba6 O18 Ru4 Yb2 -","2","0.0833333","","Doi, Yoshihiro; Hinatsu, Yukio","Magnetic and calorimetric studies on Ba3LnRu2O9 (Ln = Gd, Ho–Yb) with 6H-perovskite structure","Journal of Materials Chemistry","2002","12","6","1792","","10.1039/b111504a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","288318","2023-12-14","17:14:09",""
"7204356","6.949","0.002","17.398","0.006","7.903","0.003","90","","90","","90","","955.5","0.6","298","2","298","2","","","","","","","","6","C m m a","-C 2a 2","67","","","","- C0 H11 Al N0 O10 P2 -","- Al H7 O10 P2 -","- Al4 H28 O40 P8 -","4","0.25","","Li, Niu; Xiang, Shouhe","Hydrothermal synthesis and crystal structure of two novel aluminophosphites containing infinite Al‒O‒Al chainsElectronic supplementary information (ESI) available: XRD patterns and views of NKX-1 and NKX-4. See http://www.rsc.org/suppdata/jm/b2/b200507g/","Journal of Materials Chemistry","2002","12","5","1397","","10.1039/b200507g","","","0.71073","MoKα","","0.0626","0.0397","","","0.085","0.0918","","","","","","0.96","","","","has coordinates","180374","2020-10-21","18:00:00",""
"7204357","29.123","0.017","6.772","0.004","6.851","0.004","90","","92.991","0.01","90","","1349.3","1.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C6 H21 Al N2 O7 P2 -","- C6 H18 Al N2 O7 P2 -","- C24 H72 Al4 N8 O28 P8 -","4","0.5","","Li, Niu; Xiang, Shouhe","Hydrothermal synthesis and crystal structure of two novel aluminophosphites containing infinite Al‒O‒Al chainsElectronic supplementary information (ESI) available: XRD patterns and views of NKX-1 and NKX-4. See http://www.rsc.org/suppdata/jm/b2/b200507g/","Journal of Materials Chemistry","2002","12","5","1397","","10.1039/b200507g","","","0.71073","MoKα","","0.0845","0.0532","","","0.1148","0.1286","","","","","","0.904","","","","has coordinates","180374","2020-10-21","18:00:00",""
"7204373","7.057","0.0007","7.1618","0.0008","9.0246","0.0009","90","","91.087","0.002","90","","456.03","0.08","496","2","496","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Ba2 F Nb O9 P2 -","- Ba2 F Nb O9 P2 -","- Ba4 F2 Nb2 O18 P4 -","2","0.5","","Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.","Hydrothermal synthesis and structures of the novel niobium phosphates Ba2[NbOF(PO4)2] and Ba3[Nb3O3F(PO4)4(HPO4)](H2O)7","Journal of Materials Chemistry","2002","12","6","1824","","10.1039/b201701f","","","0.71073","MoKα","","0.019","0.0186","","","0.0439","0.0441","","","","","","1.224","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204374","9.4824","0.0006","15.0067","0.0009","18.4897","0.0011","90","","90","","90","","2631.1","0.3","293","2","293","2","","","","","","","","6","I m m m","-I 2 2","71","","","","- Ba3 F H14 Nb3 O30 P5 -","- Ba2.9844 F Nb3 O29.434 P5.002 -","- Ba11.9376 F4 Nb12 O117.736 P20.008 -","4","0.25","","Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.","Hydrothermal synthesis and structures of the novel niobium phosphates Ba2[NbOF(PO4)2] and Ba3[Nb3O3F(PO4)4(HPO4)](H2O)7","Journal of Materials Chemistry","2002","12","6","1824","","10.1039/b201701f","","","0.71073","MoKα","","0.0488","0.0402","","","0.1003","0.1042","","","","","","1.077","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204382","18.419","0.005","17.565","0.005","20.638","0.005","90","","109.861","0.005","90","","6280","3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","C70Ar3Tl","","","- C103 H20 Cl4 F9 Tl -","- C103 H20 Cl4 F9 Tl -","- C412 H80 Cl16 F36 Tl4 -","4","1","","Sawamura, Masaya; Toganoh, Motoki; Iikura, Hitoshi; Matsuo, Yutaka; Hirai, Atsushi; Nakamura, Eiichi","Cu(i)-mediated regioselective tri-addition of Grignard reagent to [70]fullerene. Synthesis of indenyl-type metal ligand embedded into graphitic structure","Journal of Materials Chemistry","2002","12","7","2109","","10.1039/b202130g","","","0.71073","MoKα","","0.2232","0.0972","","","0.2408","0.3192","","","","","","1.015","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204387","15.252","0.004","16.083","0.005","6.8902","0.0009","100.22","0.02","98.09","0.02","100.55","0.02","1608.8","0.7","100","","","","","","","","","","","8","P -1","-P 1","2","","","","- C54 H29 As2 Cl F12 N8 O4 S16 -","- C54 H29 As2 Cl F12 N8 O4 S16 -","- C54 H29 As2 Cl F12 N8 O4 S16 -","1","0.5","","Uruichi, M.; Yakushi, K.; Shirahata, T.; Takahashi, K.; Mori, T.; Nakamura, T.","Structural phase transition in quasi-one-dimensional conductors (BDTFP)2X(PhCl)0.5 (X = PF6 and AsF6) [BDTFP = 5,7-bis(1,3-dithiol-2-ylidene)-5,7-dihydrofuro[3,4-b]pyrazine; PhCl = chlorobenzene]","Journal of Materials Chemistry","2002","12","9","2696","","10.1039/b202259c","","","0.7107","MoKα","","","0.0648","","","","0.087","","","","","","1.725","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204388","15.628","0.003","16.285","0.007","6.9693","0.0007","100.28","0.02","102.86","0.01","97.13","0.03","1676.5","0.8","290","","","","","","","","","","","8","P -1","-P 1","2","","","","- C54 H29 As2 Cl F12 N8 O4 S16 -","- C54 H28 As2 Cl F12 N8 O4 S16 -","- C54 H28 As2 Cl F12 N8 O4 S16 -","1","0.5","","Uruichi, M.; Yakushi, K.; Shirahata, T.; Takahashi, K.; Mori, T.; Nakamura, T.","Structural phase transition in quasi-one-dimensional conductors (BDTFP)2X(PhCl)0.5 (X = PF6 and AsF6) [BDTFP = 5,7-bis(1,3-dithiol-2-ylidene)-5,7-dihydrofuro[3,4-b]pyrazine; PhCl = chlorobenzene]","Journal of Materials Chemistry","2002","12","9","2696","","10.1039/b202259c","","","0.7107","MoKα","","","0.0757","","","","0.103","","","","","","1.941","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204389","15.159","0.004","16.159","0.003","13.749","0.002","103.585","0.01","99.92","0.02","78.7","0.02","3181.9","1.2","90","","","","","","","","","","","8","P -1","-P 1","2","","","","- C54 H29 Cl F12 N8 O4 P2 S16 -","- C54 H29 Cl F12 N8 O4 P2 S16 -","- C108 H58 Cl2 F24 N16 O8 P4 S32 -","2","1","","Uruichi, M.; Yakushi, K.; Shirahata, T.; Takahashi, K.; Mori, T.; Nakamura, T.","Structural phase transition in quasi-one-dimensional conductors (BDTFP)2X(PhCl)0.5 (X = PF6 and AsF6) [BDTFP = 5,7-bis(1,3-dithiol-2-ylidene)-5,7-dihydrofuro[3,4-b]pyrazine; PhCl = chlorobenzene]","Journal of Materials Chemistry","2002","12","9","2696","","10.1039/b202259c","","","0.7107","MoKα","","","0.0513","","","","0.0668","","","","","","1.225","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204390","15.438","0.005","16.147","0.002","6.9811","0.0008","100.911","0.009","101.81","0.02","97.25","0.02","1647.8","0.6","290","","","","","","","","","","","8","P -1","-P 1","2","","","","- C54 H29 Cl F12 N8 O4 P2 S16 -","- C54 H28 Cl F12 N8 O4 P2 S16 -","- C54 H28 Cl F12 N8 O4 P2 S16 -","1","0.5","","Uruichi, M.; Yakushi, K.; Shirahata, T.; Takahashi, K.; Mori, T.; Nakamura, T.","Structural phase transition in quasi-one-dimensional conductors (BDTFP)2X(PhCl)0.5 (X = PF6 and AsF6) [BDTFP = 5,7-bis(1,3-dithiol-2-ylidene)-5,7-dihydrofuro[3,4-b]pyrazine; PhCl = chlorobenzene]","Journal of Materials Chemistry","2002","12","9","2696","","10.1039/b202259c","","","0.7107","MoKα","","","0.0473","","","","0.0502","","","","","","1.656","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204402","11.216","0.005","11.216","0.005","8.954","0.005","90","0.005","90","0.005","90","0.005","1126.4","0.9","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C8 H16 Cd K2 O24 Zr -","- C8 H16 Cd K2 O24 Zr -","- C16 H32 Cd2 K4 O48 Zr2 -","2","0.25","","Erwann Jeanneau; Nathalie Audebrand; Daniel Louër","Synthesis, crystal structure and thermal behaviour of CdZrK2(C2O4)4·8H2O","J. Mater. Chem.","2002","12","8","2383","2389","10.1039/b202463m","","","0.71069","MoKα","","0.0228","0.0207","","","0.0459","0.0468","","","","","","1.099","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204405","6.03828","0.00001","9.44267","0.00002","12.07438","0.00003","90","","90","","90","","688.451","0.003","","","","","","","","","","","","4","P m c n","-P 2n 2a","62","Bismuth Lead Vanadate","","","- Bi O6 Pb2 V -","- Bi4 O24 Pb8 V4 -","- Bi4 O24 Pb8 V4 -","","","","Evans, Ivana Radosavljevic; Evans, John S. O.; Howard, Judith A. K.","Variable temperature structural study of bismuth lead vanadate, BiPb2VO6","Journal of Materials Chemistry","2002","12","9","2648","","10.1039/b202648a","","","","","","","","","","","","","","","","","","","","","has coordinates","277889","2022-09-15","15:31:09",""
"7204406","7.71529","0.00001","5.84864","0.00001","29.08203","0.00003","90","","94.255","0.00004","90","","1308.68","0.003","","","","","","","","","","","","4","P 1 n 1","P -2yac","7","Bismuth Lead Vanadate","","","- Bi O6 Pb2 V -","- Bi8 O48 Pb16 V8 -","- Bi8 O48 Pb16 V8 -","","","","Evans, Ivana Radosavljevic; Evans, John S. O.; Howard, Judith A. K.","Variable temperature structural study of bismuth lead vanadate, BiPb2VO6","Journal of Materials Chemistry","2002","12","9","2648","","10.1039/b202648a","","","","","","","","","","","","","","","","","","","","","has coordinates","277890","2022-09-15","15:36:09",""
"7204416","16.63","0.05","16.63","0.06","16","0.03","90","","90","","120","","3832","19","293","","293","","","","","","","","synthesized","4","P 3","P 3","143","","","","- C158 H158 N34 O45 -","- C53 H52 N11 O15 -","- C159 H156 N33 O45 -","3","1","","Mukhopadhyay, Pritam; Bharadwaj, Parimal K.; Savitha, G.; Krishnan, Anu; Das, Puspendu K.","A new class of three dimensional D-π-A trigonal cryptand derivatives for second-order nonlinear optics","Journal of Materials Chemistry","2002","12","8","2237","","10.1039/b202770b","","","0.71073","MoK-alpha","","0.113","0.066","","0.109","0.065","","","","2.903","2.321","2.321","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204417","12.473","0.004","21.974","0.005","36.982","0.017","90","","90","","90","","10136","6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C53 H57 N9 O9 -","- C53 H57 N9 O9 -","- C424 H456 N72 O72 -","8","1","","Mukhopadhyay, Pritam; Bharadwaj, Parimal K.; Savitha, G.; Krishnan, Anu; Das, Puspendu K.","A new class of three dimensional D-π-A trigonal cryptand derivatives for second-order nonlinear optics","Journal of Materials Chemistry","2002","12","8","2237","","10.1039/b202770b","","","0.71073","MoK-alpha","","0.2868","0.0695","","","0.1541","0.211","","","","","","1.016","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204418","11.798","0.002","12.137","0.007","19.707","0.006","89.51","0.06","79.11","0.02","75.62","0.04","2682.1","1.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H54 N12 O15 -","- C53 H54 N12 O15 -","- C106 H108 N24 O30 -","2","1","","Mukhopadhyay, Pritam; Bharadwaj, Parimal K.; Savitha, G.; Krishnan, Anu; Das, Puspendu K.","A new class of three dimensional D-π-A trigonal cryptand derivatives for second-order nonlinear optics","Journal of Materials Chemistry","2002","12","8","2237","","10.1039/b202770b","","","0.71073","MoKα","","0.3104","0.084","","","0.2234","0.3421","","","","","","0.935","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204419","13.2413","0.0011","12.5696","0.0008","15.3847","0.0011","90","","95.004","0.006","90","","2550.8","0.3","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","7,7-bis(N,N-dimethylethylenediamino)-8,8- dicyanoquinodimethane : terephthalic acid","","- C26 H32 N6 O4 -","- C26 H32 N6 O4 -","- C104 H128 N24 O16 -","4","1","","Jayanty, S.; Gangopadhyay, P.; Radhakrishnan, T. P.","Steering molecular dipoles from centrosymmetric to a noncentrosymmetric and SHG active assembly using remote functionality and complexationElectronic supplementary information (ESI) available: powder SHG variation with particle size for DMEDQ-TPA. See http://www.rsc.org/suppdata/jm/b2/b202804m/","Journal of Materials Chemistry","2002","12","9","2792","","10.1039/b202804m","","","0.71073","MoKα","","0.1131","0.0502","","","0.1171","0.1173","","","","","","0.951","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204420","13.121","0.003","10.192","0.004","15.463","0.002","90","","111.94","0.02","90","","1918.1","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","7,7-bis(N,N-dimethylethylenediamino)- 8,8-dicyanoquinodimethane","","- C18 H26 N6 -","- C18 H26 N6 -","- C72 H104 N24 -","4","1","","Jayanty, S.; Gangopadhyay, P.; Radhakrishnan, T. P.","Steering molecular dipoles from centrosymmetric to a noncentrosymmetric and SHG active assembly using remote functionality and complexationElectronic supplementary information (ESI) available: powder SHG variation with particle size for DMEDQ-TPA. See http://www.rsc.org/suppdata/jm/b2/b202804m/","Journal of Materials Chemistry","2002","12","9","2792","","10.1039/b202804m","","","0.71073","MoKα","","0.2158","0.0483","","","0.1298","0.1904","","","","","","0.946","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204438","28.856","0.004","7.518","0.003","16.377","0.005","90","","106.73","0.02","90","","3402.4","1.8","299.2","","299.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H36 N Ni S6 -","- C30 H34 N Ni0.5 S6.75 -","- C120 H136 N4 Ni2 S27 -","4","0.5","","Kean, Christopher L.; Miller, David O.; Pickup, Peter G.","Thiophene-substituted nickel dithiolene complexes. Precursors for low band gap conjugated metallopolymers","Journal of Materials Chemistry","2002","12","10","2949","","10.1039/b204090e","","","0.7107","MoKα","","0.2242","0.098","","0.1","","0.094","","","2.274","","","3.31","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204439","14.522","0.002","19.507","0.002","8.667","0.001","101.18","0.01","98.39","0.01","79.837","0.009","2354.9","0.5","299.2","","299.2","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H48 N1.5 Ni1.5 S12 -","- C39 H48 N1.25 Ni1.25 S13.125 -","- C78 H96 N2.5 Ni2.5 S26.25 -","2","1","","Kean, Christopher L.; Miller, David O.; Pickup, Peter G.","Thiophene-substituted nickel dithiolene complexes. Precursors for low band gap conjugated metallopolymers","Journal of Materials Chemistry","2002","12","10","2949","","10.1039/b204090e","","","0.7107","MoKα","","0.1529","0.063","","0.054","","0.05","","","1.995","","","2.49","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204444","11.6342","0.0012","4.1608","0.0005","40.513","0.005","90","","98.07","0.006","90","","1941.7","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(ethylenedithio)tetrathiafulvalenium bis(1,2,5-thiadizole-3,4-dithiol) iron(III)","","- C24 H16 Fe N4 S22 -","- C24 H16 Fe N4 S22 -","- C48 H32 Fe2 N8 S44 -","2","0.5","","Paola Deplano; Laura Leoni; Maria Laura Mercuri; John A. Schlueter; Urs Geiser; Hau H. Wang; Aravinda M. Kini; Jamie L. Manson; Carlos J. Gómez-García; Eugenio Coronado; H.-J. Koo; M.-H. Whangbo","A two-dimensional radical salt based upon BEDT-TTF and the dimeric, magnetic anion [Fe(tdas)2]22−: (BEDT-TTF)2[Fe(tdas)2](tdas = 1,2,5-thiadiazole-3,4-dithiolate)","J. Mater. Chem.","2002","12","12","3570","3577","10.1039/b204435h","","","0.71073","MoKα","","0.2474","0.1918","","","0.4787","0.4876","","","","","","2.569","","","","has coordinates","180375","2020-10-21","18:00:00",""
"7204460","9.2463","0.0018","33.461","0.007","7.2285","0.0014","90","","90","","90","","2236.4","0.8","150","2","150","2","","","","","","","","4","I b a 2","I 2 -2c","45","","","","- C14 H13 N O -","- C14 H13 N O -","- C112 H104 N8 O8 -","8","1","","Huck, Deborah M.; Loc Nguyen, H.; Coles, Simon J.; Hursthouse, Michael B.; Donnio, Bertrand; Bruce, Duncan W.","Mesomorphic silver(i) complexes of 4-alkyloxy-2???-stilbazoles and 4-alkyloxy-3???-stilbazoles. Crystal and molecular structure of 4-methoxy-2???-stilbazoleElectronic supplementary information (ESI) available: bond lengths and angles for 4-methoxy-2???-stilbazole. See http://www.rsc.org/suppdata/jm/b2/b204820e/","Journal of Materials Chemistry","2002","12","10","2879","","10.1039/b204820e","","","0.71073","MoKα","","0.0722","0.0576","","","0.1372","0.1471","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204477","11.1674","0.0004","7.763","0.0003","24.1683","0.0009","90","","90.73","0.001","90","","2095.04","0.14","569","2","569","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(phenyl)-(3'-nitrobenzo[d])-(4''-diethylaminobenzo[h])-1,3-dioxa-6-aza-2-boracyclonon-6-ene","","- C23 H22 B N3 O4 -","- C23 H22 B N3 O4 -","- C92 H88 B4 N12 O16 -","4","1","","Horacio Reyes; Blanca M. Muñoz; Norberto Farfán; Rosa Santillan; Susana Rojas-Lima; Pascal G. Lacroix; Keitaro Nakatani","Synthesis, crystal structures, and quadratic nonlinear optical properties in a series of push‒pull boronate derivatives","J. Mater. Chem.","2002","12","10","2898","2903","10.1039/b205308j","","","0.71073","MoKα","","0.0613","0.0441","","","0.1154","0.125","","","","","","1.051","","","","has coordinates","194582","2020-10-21","18:00:00",""
"7204478","11.229","","15.668","","12.587","","90","","108.23","","90","","2103.36","","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/a 1","-P 2yab","14","","2-(4-fluorophenyl)-(3'-nitrobenzo[d])-(4''-diethylaminobenzo[h])-1,3-dioxa-6-aza-2-boracyclonon-6-ene","","- C23 H21 B F N3 O4 -","- C23 H21 B F N3 O4 -","- C92 H84 B4 F4 N12 O16 -","4","1","","Horacio Reyes; Blanca M. Muñoz; Norberto Farfán; Rosa Santillan; Susana Rojas-Lima; Pascal G. Lacroix; Keitaro Nakatani","Synthesis, crystal structures, and quadratic nonlinear optical properties in a series of push‒pull boronate derivatives","J. Mater. Chem.","2002","12","10","2898","2903","10.1039/b205308j","","x-ray","0.71073","MoKα","","0.1578","0.0502","","","0.1249","0.1641","","","","","","1.059","","","","has coordinates","194582","2020-10-21","18:00:00",""
"7204479","11.27","0.03","16.565","0.009","12.27","0.012","90","0.06","107.45","0.04","90","0.09","2185","6","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/a 1","-P 2yab","14","","2-(4-Bromophenyl)-(3'-nitrobenzo[d])-(4''-diethylaminobenzo[h])-1,3-dioxa-6-aza-2-boracyclonon-6-ene","","- C23 H21 B Br N3 O4 -","- C23 H21 B Br N3 O4 -","- C92 H84 B4 Br4 N12 O16 -","4","1","","Horacio Reyes; Blanca M. Muñoz; Norberto Farfán; Rosa Santillan; Susana Rojas-Lima; Pascal G. Lacroix; Keitaro Nakatani","Synthesis, crystal structures, and quadratic nonlinear optical properties in a series of push‒pull boronate derivatives","J. Mater. Chem.","2002","12","10","2898","2903","10.1039/b205308j","","x-ray","0.71073","MoKα","","0.1605","0.0431","","","0.1111","0.1524","","","","","","0.973","","","","has coordinates","194582","2020-10-21","18:00:00",""
"7204480","11.0215","0.0002","12.7768","0.0002","13.2584","0.0001","98.494","0.001","102.203","0.001","114.022","0.001","1608.65","0.05","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H20 Cu F12 N2 O4 -","- C14 H20 Cu F12 N2 O4 -","- C42 H60 Cu3 F36 N6 O12 -","3","1.5","","Chi, Yun; Hsu, Peng-Fu; Liu, Chao-Shiuan; Ching, Wei-Li; Chou, Tsung-Yi; Carty, Arthur J.; Peng, Shie-Ming; Lee, Gene-Hsiang; Chuang, Shiow-Huey","Fluorinated aminoalkoxide CuII complexes: new CVD precursors for deposition of copper metal","Journal of Materials Chemistry","2002","12","12","3541","","10.1039/b205419a","","","0.71073","MoKα","","0.0614","0.0435","","0.1011","0.0932","","","","1.013","1.034","1.034","","","","","has coordinates","180375","2020-10-21","18:00:00",""
"7204481","9.9469","0.0004","10.7389","0.0004","12.824","0.0005","65.919","0.001","74.578","0.001","83.479","0.001","1205.57","0.08","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C16 H26 Cu F12 N2 O3 -","- C16 H26 Cu F12 N2 O3 -","- C32 H52 Cu2 F24 N4 O6 -","2","1","","Chi, Yun; Hsu, Peng-Fu; Liu, Chao-Shiuan; Ching, Wei-Li; Chou, Tsung-Yi; Carty, Arthur J.; Peng, Shie-Ming; Lee, Gene-Hsiang; Chuang, Shiow-Huey","Fluorinated aminoalkoxide CuII complexes: new CVD precursors for deposition of copper metal","Journal of Materials Chemistry","2002","12","12","3541","","10.1039/b205419a","","","0.71073","MoKα","","0.0513","0.0291","","","0.0604","0.0637","","","","","","1.006","","","","has coordinates","180375","2020-10-21","18:00:00",""
"7204482","14.7856","0.0014","14.7856","0.0014","33.637","0.009","90","","90","","120","","6368.3","1.9","293","2","293","2","","","","","","","","8","R 3 c :H","R 3 -2""c","161","","","","- C24 H60 Ag3 I4 Mo N3 O S3 -","- C24 H60 Ag3 I4 Mo N3 O S3 -","- C144 H360 Ag18 I24 Mo6 N18 O6 S18 -","6","0.333333","","Zhang, Chi; Song, Yinglin; Wang, Xin; Kühn, Fritz E.; Wang, Yuxiao; Xu, Yan; Xin, Xinquan","Large third-order optical nonlinearity of two cubane-like clusters containing oxotrithiometalate anions and silver: synthesis, characterization, reactivity, and NLO properties‒structure correlation","Journal of Materials Chemistry","2003","13","3","571","","10.1039/b205450g","","","0.71073","MoKα","","0.0495","0.0404","","","0.1013","0.1075","","","","","","1.004","","","","has coordinates","180375","2020-10-21","18:00:00",""
"7204487","8.915","0.0005","10.6693","0.0007","11.0624","0.0007","107.456","0.001","97.5","0.001","114.034","0.001","877.33","0.09","158","2","158","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H17 N3 O2 -","- C21 H17 N3 O2 -","- C42 H34 N6 O4 -","2","1","","Liang, Yongchao; Dvornikov, A. S.; Rentzepis, P. M.","New near infrared-sensitive photochromic fluorescing molecules","Journal of Materials Chemistry","2003","13","2","286","","10.1039/b206577k","","","0.71073","MoKα","","0.0993","0.0526","","","0.1169","0.1446","","","","","","1.011","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204491","7.2582","0.0002","7.3697","0.0002","11.8514","0.0003","90","","99.4053","0.0019","90","","625.42","0.03","150","","150","","","","","","","","?","6","P 1 2/c 1","-P 2yc","13","","","","- C3 H14 N2 O11 S2 U -","- C3 H14 N2 O11 S2 U -","- C6 H28 N4 O22 S4 U2 -","2","0.5","","Thomas, Paul M.; Norquist, Alexander J.; Doran, Michael B.; O'Hare, Dermot","Organically templated uranium(vi) sulfates: understanding phase stability using composition space","Journal of Materials Chemistry","2003","13","1","88","","10.1039/b206694g","","","0.71073","MoKα","","","0.0185","","","","0.0434","","","","","","0.8569","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204492","10.7391","0.0003","10.3791","0.0003","18.0265","0.0007","90","","106.942","0.0012","90","","1922.07","0.11","150","","150","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C3 H14 N2 O17 S3 U2 -","- C3 H14 N2 O17 S3 U2 -","- C12 H56 N8 O68 S12 U8 -","4","1","","Thomas, Paul M.; Norquist, Alexander J.; Doran, Michael B.; O'Hare, Dermot","Organically templated uranium(vi) sulfates: understanding phase stability using composition space","Journal of Materials Chemistry","2003","13","1","88","","10.1039/b206694g","","","0.71073","MoKα","","","0.0343","","","","0.0825","","","","","","0.9884","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204502","6.6605","0.0001","26.7013","0.0006","10.0256","0.0003","90","","104.874","0.001","90","","1723.25","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","lanthanum ethylenediammonium sulfate hexahydrate","","","- C6 H42 La2 N6 O30 S6 -","- C6 H42 La2 N6 O30 S6 -","- C12 H84 La4 N12 O60 S12 -","2","0.5","","Thierry Bataille; Daniel Louër","Two new diamine templated lanthanum sulfates, La2(H2O)2(C4H12N2)(SO4)4 and La2(H2O)2(C2H10N2)3(SO4)6·4H2O, with 3D and 2D crystal structures","J. Mater. Chem.","2002","12","12","3487","3493","10.1039/b207212m","","","0.71073","MoKα","","0.0919","0.0426","","","0.0744","0.0882","","","","","","0.988","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204503","16.7936","0.0002","9.5858","0.0001","22.5827","0.0003","90","0.005","104.216","0.0004","90","0.005","3524.03","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","lanthanum piperazine sulfate dihydrate","","","- C4 H16 La2 N2 O18 S4 -","- C4 H16 La2 N2 O18 S4 -","- C32 H128 La16 N16 O144 S32 -","8","2","","Thierry Bataille; Daniel Louër","Two new diamine templated lanthanum sulfates, La2(H2O)2(C4H12N2)(SO4)4 and La2(H2O)2(C2H10N2)3(SO4)6·4H2O, with 3D and 2D crystal structures","J. Mater. Chem.","2002","12","12","3487","3493","10.1039/b207212m","","","0.71073","MoKα","","0.0752","0.043","","","0.097","0.1144","","","","","","1.068","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204507","5.3419","0.0008","15.232","0.002","11.084","0.003","90","0","90","0","90","0","901.9","0.3","","","295","","","","","","","","?","4","P b c a","-P 2ac 2ab","61","","","","- Bi Ge O5 Y -","- Bi Ge O5 Y -","- Bi8 Ge8 O40 Y8 -","8","1","","Concepción Cascales; Juan Antonio Campa; Enrique Gutiérrez Puebla; M. Angeles Monge; Caridad Ruíz Valero; Isidoro Rasines","New rare-earth (Y, Yb) bismuth(III) germanates. An initial study of a promising series","J. Mater. Chem.","2002","12","12","3626","3630","10.1039/b207638c","","","0.7107","MoKα","","","3.9","","12.3","","4.6","","","","","","0.8","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204508","5.315","0.002","15.225","0.002","11.025","0.002","90","0","90","0","90","0","892.2","0.4","","","295","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Bi Ge O5 Yb -","- Bi Ge O5 Yb -","- Bi8 Ge8 O40 Yb8 -","8","1","","Concepción Cascales; Juan Antonio Campa; Enrique Gutiérrez Puebla; M. Angeles Monge; Caridad Ruíz Valero; Isidoro Rasines","New rare-earth (Y, Yb) bismuth(III) germanates. An initial study of a promising series","J. Mater. Chem.","2002","12","12","3626","3630","10.1039/b207638c","","","0.7107","MoKα","","4","4.9","","","","","","","","","","0.9","","","","has coordinates","191973","2020-10-21","18:00:00",""
"7204516","14.0654","0.0004","6.8771","0.0002","6.9255","0.0003","90","","90","","90","","669.9","0.04","","","295","","","","","","","","","4","C m c 21","C 2c -2","36","Vanadyl diacetate","","","- C8 H12 O10 V2 -","- C8 O10 V2 -","- C16 O20 V4 -","2","0.25","","Weeks, Curtis; Song, Yanning; Suzuki, Masatsugu; Chernova, Natasha A.; Zavalij, Peter Y.; Whittingham, M. Stanley","The one dimensional chain structures of vanadyl glycolate and vanadyl acetateElectronic supplementary information (ESI) available: difference plots and reflections lists for VO(CH3COO)2 and VO(OCH2CH2O). See http://www.rsc.org/suppdata/jm/b2/b208100h/","Journal of Materials Chemistry","2003","13","6","1420","","10.1039/b208100h","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","191973","2020-10-21","18:00:00",""
"7204517","9.2707","0.0008","9.7345","0.0009","9.9132","0.0008","90","","106.029","0.003","90","","859.84","0.13","","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Vanadyl glycolate","","","- C8 H16 O12 V4 -","- C8 H16 O12 V4 -","- C16 H32 O24 V8 -","2","0.25","","Weeks, Curtis; Song, Yanning; Suzuki, Masatsugu; Chernova, Natasha A.; Zavalij, Peter Y.; Whittingham, M. Stanley","The one dimensional chain structures of vanadyl glycolate and vanadyl acetateElectronic supplementary information (ESI) available: difference plots and reflections lists for VO(CH3COO)2 and VO(OCH2CH2O). See http://www.rsc.org/suppdata/jm/b2/b208100h/","Journal of Materials Chemistry","2003","13","6","1420","","10.1039/b208100h","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","191973","2020-10-21","18:00:00",""
"7204518","8.3456","0.0004","9.1508","0.0003","27.9462","0.0014","90","","91.735","0.002","90","","2133.24","0.16","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C29 H22 N2 -","- C29 H22 N2 -","- C116 H88 N8 -","4","1","","C. Q. Ma; L. Q. Zhang; J. H. Zhou; X. S. Wang; B. W. Zhang; Y. Cao; P. Bugnon; M. Schaer; F. Nüesch; D. Q. Zhang; Y. Qiu","1,3-Diphenyl-5-(9-phenanthryl)-4,5-dihydro-1H-pyrazole (DPPhP): structure, properties, and application in organic light-emitting diodes","J. Mater. Chem.","2002","12","12","3481","3486","10.1039/b208130j","","","0.71073","MoKα","","0.1057","0.0563","","","0.1342","0.1554","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204519","8.4101","0.0002","7.809","0.0002","13.6228","0.0005","90","","104.763","0.001","90","","865.14","0.04","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N-dimethylpyrrolidinium thiocyanate","","- C7 H14 N2 S -","- C7 H14 N2 S -","- C28 H56 N8 S4 -","4","1","","Pringle, Jennifer M.; Golding, Jake; Forsyth, Craig M.; Deacon, Glen B.; Forsyth, Maria; MacFarlane, Douglas R.","Physical trends and structural features in organic salts of the thiocyanate anion","Journal of Materials Chemistry","2002","12","12","3475","","10.1039/b208372h","","","0.71073","MoKα","","0.0641","0.0355","","","0.0854","0.0967","","","","","","0.993","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204520","8.7507","0.0002","9.4424","0.0002","13.7058","0.0002","74.0139","0.0009","86.8875","0.001","81.312","0.001","1076.09","0.04","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C16 H16 F12 N2 O4 Pd -","- C16 H16 F12 N2 O4 Pd -","- C32 H32 F24 N4 O8 Pd2 -","2","1","","Liu, Yan-Hsiu; Cheng, Yi-Ching; Tung, Yung-Liang; Chi, Yun; Chen, Yao-Lun; Liu, Chao-Shiuan; Peng, Shie-Ming; Lee, Gene-Hsiang","Synthesis and characterization of fluorinated β-ketoiminate and imino-alcoholate Pd complexes: precursors for palladium chemical vapor deposition","Journal of Materials Chemistry","2003","13","1","135","142","10.1039/b208535f","","","0.71073","MoKα","","0.0428","0.0323","","","0.0792","0.0859","","","","","","1.087","","","","has coordinates,has disorder","275117","2022-05-06","16:16:55",""
"7204521","5.8906","0.0001","10.274","0.0002","10.9422","0.0001","77.307","0.001","89.906","0.001","75.714","0.001","625.091","0.018","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H24 F12 N2 O4 Pd -","- C18 H24 F12 N2 O4 Pd -","- C18 H24 F12 N2 O4 Pd -","1","0.5","","Liu, Yan-Hsiu; Cheng, Yi-Ching; Tung, Yung-Liang; Chi, Yun; Chen, Yao-Lun; Liu, Chao-Shiuan; Peng, Shie-Ming; Lee, Gene-Hsiang","Synthesis and characterization of fluorinated β-ketoiminate and imino-alcoholate Pd complexes: precursors for palladium chemical vapor deposition","Journal of Materials Chemistry","2003","13","1","135","142","10.1039/b208535f","","","0.71073","MoKα","","0.0273","0.0262","","0.0636","0.063","","","","1.061","1.064","1.064","","","","","has coordinates","275117","2022-05-06","16:16:56",""
"7204528","14.627","0.0006","15.1447","0.0007","16.6446","0.0007","90","","90","","90","","3687.1","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- H O8.5 Rb2 Si2 U -","- O8.5 Rb2 Si2 U -","- O136 Rb32 Si32 U16 -","16","2","","Huang, Jin; Wang, Xiqu; Jacobson, Allan J.","Hydrothermal synthesis and structures of the new open-framework uranyl silicates Rb4(UO2)2(Si8O20) (USH-2Rb), Rb2(UO2)(Si2O6)·H2O (USH-4Rb) and A2(UO2)(Si2O6)·0.5H2O (USH-5A; A = Rb, Cs)","Journal of Materials Chemistry","2003","13","2","191","","10.1039/b208787c","","","0.71073","MoKα","","0.0577","0.0346","","","0.1037","0.1092","","","","","","1.18","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204529","7.6989","0.0008","20.974","0.002","12.05","0.0012","90","","97.919","0.002","90","","1927.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- H2 O9 Rb2 Si2 U -","- O9 Rb2 Si2 U -","- O72 Rb16 Si16 U8 -","8","2","","Huang, Jin; Wang, Xiqu; Jacobson, Allan J.","Hydrothermal synthesis and structures of the new open-framework uranyl silicates Rb4(UO2)2(Si8O20) (USH-2Rb), Rb2(UO2)(Si2O6)·H2O (USH-4Rb) and A2(UO2)(Si2O6)·0.5H2O (USH-5A; A = Rb, Cs)","Journal of Materials Chemistry","2003","13","2","191","","10.1039/b208787c","","","0.71073","MoKα","","0.0704","0.0509","","","0.1264","0.1366","","","","","","1.001","","","","has coordinates","209504","2020-10-21","18:00:00",""
"7204530","15.0472","0.0008","15.4265","0.0008","16.7315","0.0009","90","","90","","90","","3883.8","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- Cs2 H O8.5 Si2 U -","- Cs2 O8.5 Si2 U -","- Cs32 O136 Si32 U16 -","16","2","","Huang, Jin; Wang, Xiqu; Jacobson, Allan J.","Hydrothermal synthesis and structures of the new open-framework uranyl silicates Rb4(UO2)2(Si8O20) (USH-2Rb), Rb2(UO2)(Si2O6)·H2O (USH-4Rb) and A2(UO2)(Si2O6)·0.5H2O (USH-5A; A = Rb, Cs)","Journal of Materials Chemistry","2003","13","2","191","","10.1039/b208787c","","","0.71073","MoKα","","0.0514","0.0291","","","0.0691","0.0738","","","","","","1.031","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204531","6.8437","0.0017","8.314","0.002","11.273","0.003","72.794","0.005","88.741","0.005","77.95","0.004","598.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- O24 Rb4 Si8 U2 -","- O24 Rb4 Si8 U2 -","- O24 Rb4 Si8 U2 -","1","0.5","","Huang, Jin; Wang, Xiqu; Jacobson, Allan J.","Hydrothermal synthesis and structures of the new open-framework uranyl silicates Rb4(UO2)2(Si8O20) (USH-2Rb), Rb2(UO2)(Si2O6)·H2O (USH-4Rb) and A2(UO2)(Si2O6)·0.5H2O (USH-5A; A = Rb, Cs)","Journal of Materials Chemistry","2003","13","2","191","","10.1039/b208787c","","","0.71073","MoKα","","0.1087","0.0688","","","0.152","0.1734","","","","","","1.04","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204539","17.725","0.005","10.149","0.003","9.547","0.003","90","","120.72","0.002","90","","1476.4","0.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C4 H12 F2 Ge4 N2 O10 Zr -","- C4 F2 Ge4 N2 O10 Zr -","- C16 F8 Ge16 N8 O40 Zr4 -","4","0.5","","Liu, Zhicheng; Weng, Linhong; Zhou, Yaming; Chen, Zhenxia; Zhao, Dongyuan","Synthesis of a new organically templated zeolite-like zirconogermanate (C4N2H12)[ZrGe4O10F2] with cavansite topologyElectronic supplementary information (ESI) available: tables of crystal data, including atomic coordinates, selected bond lengths and angles, and thermal parameters, and also a SEM image of FDZG-1. See http://www.rsc.org/suppdata/jm/b2/b209801f/","Journal of Materials Chemistry","2003","13","2","308","","10.1039/b209801f","","","0.71073","MoKα","","0.0298","0.0284","","","0.0772","0.078","","","","","","1.171","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204540","3.4762","0.0007","3.4762","0.0007","15.342","0.002","90","","90","","120","","160.55","0.05","150","2","150","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","sodium niobium diselenide","","","- Na0.5 Nb Se2 -","- Na0.498 Nb Se2 -","- Na0.996 Nb2 Se4 -","2","0.0833333","","Salyer, Pamela A.; Barker, Marten G.; Blake, Alexander J.; Gregory, Duncan H.; Weston, David P.; Wilson, Claire","New metathesis routes to layered dichalcogenides: synthesis, crystal growth and structure of NayNbX2 (y = 0.5, X = S, Se)","Journal of Materials Chemistry","2003","13","2","175","","10.1039/b209828h","","","0.71069","MoKα","","0.023","0.0191","","","0.0474","0.0487","","","","","","1.122","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204541","3.3533","0.0004","3.3533","0.0004","14.547","0.003","90","","90","","120","","141.66","0.04","150","2","150","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","sodium niobium disulfide","","","- Na0.51 Nb S2 -","- Na0.5 Nb S2 -","- Na Nb2 S4 -","2","0.0833333","","Salyer, Pamela A.; Barker, Marten G.; Blake, Alexander J.; Gregory, Duncan H.; Weston, David P.; Wilson, Claire","New metathesis routes to layered dichalcogenides: synthesis, crystal growth and structure of NayNbX2 (y = 0.5, X = S, Se)","Journal of Materials Chemistry","2003","13","2","175","","10.1039/b209828h","","","0.71069","MoKα","","0.0206","0.0191","","","0.0639","0.065","","","","","","0.983","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204542","10.616","0.002","18.141","0.003","18.628","0.003","90","","103.23","0.02","90","","3492.3","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H37 Ag O2 P2 -","- C41 H37 Ag O2 P2 -","- C164 H148 Ag4 O8 P8 -","4","1","","Edwards, Dennis A.; Mahon, Mary F.; Molloy, Kieran C.; Ogrodnik, Virginie","Aerosol-assisted chemical vapour deposition of silver films from adducts of functionalised silver carboxylates","Journal of Materials Chemistry","2003","13","3","563","","10.1039/b210085c","","","0.7093","","","0.046","0.0245","","0.0646","0.0548","","","","1.045","1.02","1.02","","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204543","12.806","0.005","12.996","0.004","13.056","0.006","66.26","0.03","62.4","0.03","72.79","0.03","1746.6","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20.5 H18.5 Ag0.5 O P -","- C20.5 H18.5 Ag0.5 O P -","- C82 H74 Ag2 O4 P4 -","4","2","","Edwards, Dennis A.; Mahon, Mary F.; Molloy, Kieran C.; Ogrodnik, Virginie","Aerosol-assisted chemical vapour deposition of silver films from adducts of functionalised silver carboxylates","Journal of Materials Chemistry","2003","13","3","563","","10.1039/b210085c","","","0.7093","","","0.0442","0.0325","","0.1109","0.0993","","","","1.061","1.07","1.07","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7204544","12.689","0.003","12.85","0.002","13.351","0.003","65.16","0.01","61.89","0.02","72.21","0.02","1726.7","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H32 Ag N O2 P2 -","- C39 H32 Ag N O2 P2 -","- C78 H64 Ag2 N2 O4 P4 -","2","1","","Edwards, Dennis A.; Mahon, Mary F.; Molloy, Kieran C.; Ogrodnik, Virginie","Aerosol-assisted chemical vapour deposition of silver films from adducts of functionalised silver carboxylates","Journal of Materials Chemistry","2003","13","3","563","","10.1039/b210085c","","","0.7093","","","0.0365","0.0249","","0.0724","0.0639","","","","0.92","0.892","0.892","","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204545","5.965","0.001","8.956","0.002","10.292","0.002","90","","91.51","0.02","90","","549.63","0.19","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C5 H7 Ag O2 -","- C5 H7 Ag O2 -","- C20 H28 Ag4 O8 -","4","1","","Edwards, Dennis A.; Mahon, Mary F.; Molloy, Kieran C.; Ogrodnik, Virginie","Aerosol-assisted chemical vapour deposition of silver films from adducts of functionalised silver carboxylates","Journal of Materials Chemistry","2003","13","3","563","","10.1039/b210085c","","","0.7093","","","0.04","0.0357","","0.1024","0.0947","","","","1.154","1.159","1.159","","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204553","8.244","0.004","8.244","0.004","8.244","0.004","90","","90","","90","","560.3","0.5","295","","295","2","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li8 Mn16 O32 -","8","0.0416667","","Björk, Helen; Gustafsson, Torbjörn; Thomas, John O.; Lidin, Sven; Petříček, Václav","Long-range ordering during delithiation of LiMn2O4 cathode material","Journal of Materials Chemistry","2003","13","3","585","","10.1039/b210265j","","x-ray","0.71073","MoKα","","0.0307","0.0207","","","0.0256","0.0262","","","","2.26","2.26","2.03","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204554","8.9755","0.0015","16.22","0.003","23.691","0.007","90","","90","","90","","3449","1.3","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C36 H44 N4 O10 -","- C36 H44 N4 O10 -","- C144 H176 N16 O40 -","4","0.5","","Neumann, Bernhard; Hegmann, Torsten; Wagner, Christoph; Ashton, Peter R.; Wolf, Raik; Tschierske, Carsten","Liquid crystalline macrocycles containing phenylpyrimidine unitsElectronic supplementary information (ESI) available: the procedures and analytical data for all compounds and a table with selected bond distances and bond angles of the crystal structure of compound C are available as supplementary data. See http://www.rsc.org/suppdata/jm/b2/b210271d/","Journal of Materials Chemistry","2003","13","4","778","","10.1039/b210271d","","","0.71073","MoKα","","0.1691","0.0547","","","0.0914","0.1237","","","","","","0.83","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204556","4.0502","0.0001","11.6459","0.0006","20.9044","0.0011","102.059","0.001","90.274","0.005","91.559","0.005","963.85","0.07","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H20 N2 -","- C28 H20 N2 -","- C56 H40 N4 -","2","1","","Liang, Fushun; Chen, Jiangshan; Cheng, Yanxiang; Wang, Lixiang; Ma, Dongge; Jing, Xiabin; Wang, Fosong","Synthesis, characterization, photoluminescent and electroluminescent properties of new conjugated 2,2?-(arylenedivinylene)bis-8-substituted quinolines","Journal of Materials Chemistry","2003","13","6","1392","","10.1039/b210408c","","","0.71073","MoKα","","0.0733","0.0541","","","0.1584","0.1696","","","","","","1.084","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204557","15.47","0.02","7.797","0.014","18.86","0.03","90","","90","","90","","2275","6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C13 H10 O4 -","- C13 H10 O4 -","- C104 H80 O32 -","8","1","","Davidson, Louise; Blencowe, Anton; Drew, Michael G. B.; Freebairn, Keith W.; Hayes, Wayne","Synthesis and evaluation of a solid supported molecular tweezer type receptor for cholesterolElectronic supplementary information (ESI) available: synthetic procedures and analytical data for compounds 3‒8. See http://www.rsc.org/suppdata/jm/b2/b210427j/","Journal of Materials Chemistry","2003","13","4","758","","10.1039/b210427j","","","0.71073","MoKα","","0.1766","0.0764","","","0.2277","0.26","","","","","","1.102","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204558","9.3592","0.001","10.577","0.004","24.232","0.003","78.042","0.017","83.862","0.007","76.41","0.014","2276.7","1","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C19 H36 F6 N3 O P -","- C8.5 H16 F3 N1.5 O0.5 P0.5 -","- C34 H64 F12 N6 O2 P2 -","4","4","","Lee, Kwang-Ming; Lee, Yi-Ting; Lin, Ivan J. B.","Supramolecular liquid crystals of amide functionalized imidazolium saltsElectronic supplementary information (ESI) available: IR, proton and carbon NMR data for all compounds. See http://www.rsc.org/suppdata/jm/b2/b210562d/","Journal of Materials Chemistry","2003","13","5","1079","","10.1039/b210562d","","","0.71073","MoKα","","0.1817","0.0958","","","0.2523","0.3117","","","","","","1.011","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204567","10.889","0.003","10.52","0.003","12.412","0.003","90","","115.7","0.02","90","","1281.2","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- F2 H18 N4 O9 P2 Zr -","- F2 H18 N4 O9 P2 Zr -","- F8 H72 N16 O36 P8 Zr4 -","4","1","","Gatta, Giacomo D.; Masci, Silvia; Vivani, Riccardo","Dimensional reduction in zirconium phosphate; from layers to ribbons to chains","Journal of Materials Chemistry","2003","13","5","1215","","10.1039/b211004k","","","0.71069","MoKα","","0.1019","0.0548","","","0.0821","0.0948","","","","","","1.081","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204568","5.3511","0.0002","9.2466","0.0003","22.6443","0.0007","90","","90","","90","","1120.43","0.07","298","","298","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- F H13 N3 O8.5 P2 Zr -","- F N3 O8.5 P2 Zr -","- F4 N12 O34 P8 Zr4 -","4","1","","Gatta, Giacomo D.; Masci, Silvia; Vivani, Riccardo","Dimensional reduction in zirconium phosphate; from layers to ribbons to chains","Journal of Materials Chemistry","2003","13","5","1215","","10.1039/b211004k","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.069","","4.36","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204569","9.4054","0.0002","10.8386","0.0002","14.5913","0.0004","70.143","0.001","73.789","0.001","89.673","0.001","1336.84","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H17.5 N0.5 O4 -","- C30 H35 N O8 -","- C60 H70 N2 O16 -","2","1","","Bushby, Richard J.; Boden, Neville; Kilner, Colin A.; Lozman, Owen R.; Lu, Zhibao; Liu, Quanying; Thornton-Pett, Mark A.","Helical geometry and liquid crystalline properties of 2,3,6,7,10,11-hexaalkoxy-1-nitrotriphenylenesElectronic supplementary information (ESI) available: calculation of dipolar interactions, details of syntheses and analytical data, DSC data, and full details of the single-crystal structure factors plus projections along the crystallographic axes. See http://www.rsc.org/suppdata/jm/b2/b211133k/","Journal of Materials Chemistry","2003","13","3","470","","10.1039/b211133k","","","0.71073","MoKα","","0.061","0.0536","","","0.1427","0.1497","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204578","12.3225","0.0011","17.9157","0.0015","13.8165","0.0013","90","","105.553","0.001","90","","2938.5","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H12 Cd N2 O8 P2 -","- C10 H12 Cd N2 O8 P2 -","- C80 H96 Cd8 N16 O64 P16 -","8","1","","Lin, Zhi-En; Sun, Yan-Qiong; Zhang, Jie; Wei, Qiao-Hua; Yang, Guo-Yu","Cd(2,2'-bipy)(H2PO4)2: the first cadmium phosphate with an organic amine acting as a ligandElectronic supplementary information (ESI) available: IR spectrum, X-ray powder diffraction patterns (experimental and simulated) and TGA curve for Cd(2,2'-bipy)(H2PO4)2, and table of hydrogen bond lengths and angles. See http://www.rsc.org/suppdata/jm/b2/b211928e/","Journal of Materials Chemistry","2003","13","3","447","","10.1039/b211928e","","","0.71073","MoKα","","0.0809","0.0539","","","0.1064","0.1206","","","","","","1.096","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204579","9.8453","0.0016","16.53","0.003","7.2587","0.0009","90","","96.531","0.011","90","","1173.6","0.3","298.2","","298.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-pyrrolylNN","","","- C11 H16 N3 O2 -","- C11 H16 N3 O2 -","- C44 H64 N12 O8 -","4","1","","Jotaro Nakazaki; InGwon Chung; Michio M. Matsushita; Tadashi Sugawara; Ryoji Watanabe; Akira Izuoka; Yuzo Kawada","Design and preparation of pyrrole-based spin-polarized donors","J. Mater. Chem.","2003","13","5","1011","1022","10.1039/b211986b","","","0.71069","MoKα","","0.0783","0.0445","","","0.1241","0.1335","","","","","","1.016","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204580","9.925","0.002","9.317","0.002","12.972","0.003","90","","107.905","0.004","90","","1141.4","0.4","288","2","288","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-pyrrolylNN","","","- C11 H16 N3 O2 -","- C11 H16 N3 O2 -","- C44 H64 N12 O8 -","4","1","","Jotaro Nakazaki; InGwon Chung; Michio M. Matsushita; Tadashi Sugawara; Ryoji Watanabe; Akira Izuoka; Yuzo Kawada","Design and preparation of pyrrole-based spin-polarized donors","J. Mater. Chem.","2003","13","5","1011","1022","10.1039/b211986b","","","0.71073","MoKα","","0.0606","0.0479","","","0.1509","0.1588","","","","","","1.051","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204581","13.0654","0.0013","14.4171","0.0019","12.874","0.0017","90","","90","","90","","2425","0.5","298.2","","298.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","3-pyrrolylNN","","","- C11 H16 N3 O2 -","- C11 H16 N3 O2 -","- C88 H128 N24 O16 -","8","1","","Jotaro Nakazaki; InGwon Chung; Michio M. Matsushita; Tadashi Sugawara; Ryoji Watanabe; Akira Izuoka; Yuzo Kawada","Design and preparation of pyrrole-based spin-polarized donors","J. Mater. Chem.","2003","13","5","1011","1022","10.1039/b211986b","","","0.71069","MoKα","","0.0674","0.0414","","","0.1172","0.1254","","","","","","1","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204582","12.284","0.004","12.657","0.005","10.953","0.004","90","","111.72","0.02","90","","1582.1","1","298.2","","298.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","4-(1'-pyrrolyl)phenylNN","","","- C17 H20 N3 O2 -","- C17 H20 N3 O2 -","- C68 H80 N12 O8 -","4","1","","Jotaro Nakazaki; InGwon Chung; Michio M. Matsushita; Tadashi Sugawara; Ryoji Watanabe; Akira Izuoka; Yuzo Kawada","Design and preparation of pyrrole-based spin-polarized donors","J. Mater. Chem.","2003","13","5","1011","1022","10.1039/b211986b","","","0.71069","MoKα","","0.1775","0.0588","","","0.1097","0.1276","","","","","","0.855","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204583","14.2727","0.0016","14.2727","0.0016","14.2727","0.0016","88.309","0.017","88.309","0.017","88.309","0.017","2903.8","0.6","301","2","301","2","","","","","","","","6","R -3 :R","-P 3*","148","","","","- C44 H8.67 F20 N4 O0.33 Pt -","- C44 H8 F20 N4 O0.333333 Pt -","- C132 H24 F60 N12 O Pt3 -","3","0.5","","Che, Chi-Ming; Hou, Yuan-Jun; Chan, Michael C. W.; Guo, Jianhua; Liu, Yu; Wang, Yue","[meso-Tetrakis(pentafluorophenyl)porphyrinato]platinum(ii) as an efficient, oxidation-resistant red phosphor: spectroscopic properties and applications in organic light-emitting diodesElectronic supplementary information available: details of photoluminescence measurements, transient absorption spectra of PtF20TPP, photophysical properties of PtF20TPP in different solvents, EL spectra and performances of OLEDs using PtF20TPP as emitters at various doping levels and crystallographic data for PtF20TPP. See http://www.rsc.org/suppdata/jm/b2/b212204a/","Journal of Materials Chemistry","2003","13","6","1362","","10.1039/b212204a","","","0.71073","MoKα","","0.0466","0.0336","","","0.0848","0.0989","","","","","","0.994","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204587","7.1367","0.0006","10.6154","0.0009","11.0626","0.0009","85.541","0.001","83.15","0.001","70.652","0.001","784.46","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H28 Cu2 N6 O18 P2 -","- C24 H28 Cu2 N6 O18 P2 -","- C24 H28 Cu2 N6 O18 P2 -","1","0.5","","Yanko Moreno; Andrés Vega; Svetlana Ushak; Ricardo Baggio; Octavio Peña; Eric Le Fur; Jean-Yves Pivan; Evgenia Spodine","Magnetic properties of phosphate-bridged copper(II) organic‒inorganic hybrid compounds","J. Mater. Chem.","2003","13","9","2381","2387","10.1039/b212463g","","","0.71073","MoKα","","0.0426","0.0347","","","0.0832","0.0865","","","","","","0.95","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204588","7.3914","0.0017","9.863","0.002","10.311","0.002","107.03","0.004","105.119","0.004","98.158","0.004","674.2","0.2","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H9 Cu N3 O6 P V -","- C10 H9 Cu N3 O6 P V -","- C20 H18 Cu2 N6 O12 P2 V2 -","2","1","","Yanko Moreno; Andrés Vega; Svetlana Ushak; Ricardo Baggio; Octavio Peña; Eric Le Fur; Jean-Yves Pivan; Evgenia Spodine","Magnetic properties of phosphate-bridged copper(II) organic‒inorganic hybrid compounds","J. Mater. Chem.","2003","13","9","2381","2387","10.1039/b212463g","","","0.71073","MoKα","","0.1393","0.057","","","0.0888","0.108","","","","","","0.765","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204589","13.9768","0.0016","22.157","0.003","9.1984","0.001","90","","103.165","0.002","90","","2773.7","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H8 N2 O5.63 P0.5 V -","- C10 H8 N2 O5.57 P0.5 V -","- C80 H64 N16 O44.56 P4 V8 -","8","1","","Yanko Moreno; Andrés Vega; Svetlana Ushak; Ricardo Baggio; Octavio Peña; Eric Le Fur; Jean-Yves Pivan; Evgenia Spodine","Magnetic properties of phosphate-bridged copper(II) organic‒inorganic hybrid compounds","J. Mater. Chem.","2003","13","9","2381","2387","10.1039/b212463g","","","0.71073","MoKα","","0.0863","0.0668","","","0.2009","0.2228","","","","","","1.077","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204590","7.413","0.001","12.9922","0.0005","14.9682","0.0005","87.8","0.1","78.85","0.1","78.09","0.1","1383.9","0.7","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C40 H32 Cu4 N8 O29 P5 V4 -","- C40 H32 Cu4 N8 O29 P5 V4 -","- C40 H32 Cu4 N8 O29 P5 V4 -","1","0.5","","Yanko Moreno; Andrés Vega; Svetlana Ushak; Ricardo Baggio; Octavio Peña; Eric Le Fur; Jean-Yves Pivan; Evgenia Spodine","Magnetic properties of phosphate-bridged copper(II) organic‒inorganic hybrid compounds","J. Mater. Chem.","2003","13","9","2381","2387","10.1039/b212463g","","","0.71069","MoKα","","0.0682","0.0682","","","0.0887","0.0887","","","","0.95","0.95","0.95","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204592","12.725","0.0003","12.8573","0.0001","21.6933","0.0004","90","","90","","90","","3549.22","0.11","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H38 Ga N O5 S4 -","- C34 H36 Ga N O4.99 S3.99 -","- C136 H144 Ga4 N4 O19.96 S15.96 -","4","1","","Deivaraj, Theivanayagam C.; Lin, Ming; Loh, Kian Ping; Yeadon, Mark; Vittal, Jagadese J.","Trialkylammonium salts of [M(SC{O}R)4]‒ (M = Ga3+ and In3+) as precursors for metal sulfide thin films","Journal of Materials Chemistry","2003","13","5","1149","","10.1039/b212856j","","","0.71073","MoKα","","0.1299","0.0691","","","0.1265","0.1482","","","","","","1.033","","","","has coordinates","180376","2020-10-21","18:00:00",""
"7204593","8.703","0.002","13.522","0.001","8.3084","0.0007","96.493","0.009","91.11","0.01","76.89","0.01","946.1","0.2","298.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H19 I N5 -","- C20 H19 I N5 -","- C40 H38 I2 N10 -","2","1","","Mukai, Kazuo; Jinno, Syunsuke; Shimobe, Yasuo; Azuma, Nagao; Taniguchi, Masateru; Misaki, Yohji; Tanaka, Kazuyoshi; Inoue, Katsuya; Hosokoshi, Yuko","Genuine organic magnetic semiconductors: electrical and magnetic properties of the TCNQ and iodide salts of methylpyridinium-substituted verdazyl radicals","Journal of Materials Chemistry","2003","13","7","1614","","10.1039/b300029j","","","1.5418","CuKα","","","0.0409","","","","0.1265","","","","","","1.383","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204598","7.7805","0.0008","9.2982","0.0011","12.251","0.002","74.53","0.013","83.433","0.013","75.538","0.011","826","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 F6 O6 Ru -","- C12 H8 F6 O6 Ru -","- C24 H16 F12 O12 Ru2 -","2","1","","Lai, Ying-Hui; Chen, Yao-Lun; Chi, Yun; Liu, Chao-Shiuan; Carty, Arthur J.; Peng, Shie-Ming; Lee, Gene-Hsiang","Deposition of Ru and RuO2 thin films employing dicarbonyl bis-diketonate ruthenium complexes as CVD source reagents","Journal of Materials Chemistry","2003","13","8","1999","","10.1039/b300517h","","","0.71073","MoKα","","0.03","0.0267","","0.0756","0.0741","","","","1.089","1.118","1.118","","","","","has coordinates,has disorder","180376","2020-10-21","18:00:00",""
"7204599","9.625","0.008","10.143","0.009","11.18","0.009","103.44","0.08","80.97","0.09","111.88","0.09","982.1","1.6","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H62 Cd2 N2 P4 Se4 -","- C26 H62 Cd2 N2 P4 Se4 -","- C26 H62 Cd2 N2 P4 Se4 -","1","0.5","","Afzaal, Mohammmad; Crouch, David; Malik, Mohammad A.; Motevalli, Majid; O'Brien, Paul; Park, Jin-Ho","Deposition of CdSe thin films using a novel single-source precursor; [MeCd{(SePiPr2)2N}]2","Journal of Materials Chemistry","2003","13","4","639","","10.1039/b300608p","","","0.71073","MoKα","","0.0409","0.0283","","","0.0705","0.0745","","","","","","1.038","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204600","13.4902","0.001","13.4902","0.0009","14.7578","0.0011","90","","90","","120","","2325.9","0.3","150","2","150","2","","","","","","","synthesis as described","6","R -3 m :H","-R 3 2""","166","","","","- C39 H24 F3 N3 O72 Si36 -","- C39 F2.88 N3 O72 Si36 -","- C39 F2.88 N3 O72 Si36 -","1","0.0277778","","Villaescusa, Luis A.; Bull, Ivor; Wheatley, Paul S.; Lightfoot, Philip; Morris, Russell E.","The location of fluoride and organic guests in ?as-made? pure silica zeolites FER and CHA","Journal of Materials Chemistry","2003","13","8","1978","","10.1039/b300728f","","","0.6984","synchrotron","","0.062","0.058","","","0.1658","0.1689","","","","","","1.17","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204601","7.3952","0.0015","14.099","0.003","18.761","0.004","90","","90","","90","","1956.1","0.7","210","2","210","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C20 H24 F4 N4 O72 Si36 -","- C24 H40 F1.6 O72 Si36 -","- C24 H40 F1.6 O72 Si36 -","1","0.125","","Villaescusa, Luis A.; Bull, Ivor; Wheatley, Paul S.; Lightfoot, Philip; Morris, Russell E.","The location of fluoride and organic guests in ?as-made? pure silica zeolites FER and CHA","Journal of Materials Chemistry","2003","13","8","1978","","10.1039/b300728f","","","0.6942","Synchrotron","","0.0539","0.0465","","","0.1281","0.1338","","","","","","1.03","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204605","20.223","0.002","7.0107","0.0005","19.581","0.002","90","","90","","90","","2776.1","0.4","293","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C9 H8 Cl O4 S5 -","- C9 H8 Cl O4 S5 -","- C72 H64 Cl8 O32 S40 -","8","1","","Philippe Leriche; Jean-Manuel Raimundo; Mathieu Turbiez; Vincent Monroche; Magali Allain; François-Xavier Sauvage; Jean Roncali; Pierre Frère; Peter J. Skabara","Linearly extended tetrathiafulvalene analogues with fused thiophene units as π-conjugated spacers","J. Mater. Chem.","2003","13","6","1324","1332","10.1039/b301149f","","","0.71073","MoKα","","0.1226","0.0502","","","0.0947","0.1117","","","","","","0.798","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204606","5.1167","","10.4646","","17.6228","","90","","90","","90","","943.599","","293","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li2 Mg2 Mo3 O12 -","- Li2.001 Mg1.999 Mo3 O12 -","- Li8.004 Mg7.996 Mo12 O48 -","4","0.5","","Sebastian, Litty; Piffard, Y.; Shukla, A. K.; Taulelle, F.; Gopalakrishnan, J.","Synthesis, structure and lithium-ion conductivity of Li2?2xMg2+x(MoO4)3 and Li3M(MoO4)3 (MIII = Cr, Fe)Electronic supplementary information (ESI) available: anisotropic displacement parameters and XRPD data for Li2Mg2(MoO4)3. See http://www.rsc.org/suppdata/jm/b3/b301189e/","Journal of Materials Chemistry","2003","13","7","1797","","10.1039/b301189e","","x-ray","0.71073","MoKα","","0.066","0.0308","","0.0251","0.024","","","","1.7","1.43","1.43","","","","","has coordinates","201370","2020-10-21","18:00:00",""
"7204609","11.937","0.001","10.53","0.001","16.956","0.002","90","","90.32","0.01","90","","2131.3","0.4","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 Cl2 Pd S4 -","- C16 H13 Cl2 Pd S4 -","- C64 H52 Cl8 Pd4 S16 -","4","1","","Mucci, Adele; Parenti, Francesca; Pigani, Laura; Seeber, Renato; Zanardi, Chiara; Pilo, Maria I.; Spano, Nadia; Manassero, Mario","The effect of Pd(ii) coordination on the properties of an alkylsulfanyl substituted polythiophene. Comparison with the corresponding monomer","Journal of Materials Chemistry","2003","13","6","1287","","10.1039/b301932m","","","0.7107","Mo-Kα","","0.046","0.046","","","0.071","","","","1.021","1.021","1.021","","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204613","28.324","0.011","13.313","0.005","16.721","0.006","90","","113.7","0.4","90","","5773","18","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","copper(i) complex","","","- C28 H28 B Cu F4 N4 O2 -","- C28 H28 B Cu F4 N4 O2 -","- C224 H224 B8 Cu8 F32 N32 O16 -","8","1","","Laurent Douce; Thanh Hung Diep; Raymond Ziessel; Antoine Skoulios; Michèle Césario","Columnar liquid crystals from wedge-shaped tetrahedral copper(I) complexes","J. Mater. Chem.","2003","13","7","1533","1539","10.1039/b302038j","","","0.7107","MoKα","","0.1141","0.0719","","0.2248","","0.1921","","","1.029","","","1.125","","","","has coordinates,has disorder","180377","2020-10-21","18:00:00",""
"7204614","17.682","0.004","6.0098","0.0012","5.1917","0.001","90","","90","","90","","551.7","0.2","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- As Cd H6 N O5 -","- As Cd N O5 -","- As4 Cd4 N4 O20 -","4","0.5","","Christopher D. Johnson; Janet M. S. Skakle; Magnus G. Johnston; Jörg Feldmann; Donald E. Macphee","Hydrothermal synthesis, crystal structure and aqueous stability of two cadmium arsenate phases, CdNH4(HAsO4)OH and Cd5H2(AsO4)4·4H2O","J. Mater. Chem.","2003","13","6","1429","1432","10.1039/b302154h","","","0.71073","MoKα","","0.0505","0.0303","","","0.0586","0.062","","","","","","0.923","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204615","18.382","0.002","9.7192","0.0013","9.9791","0.0013","90","","96.369","0.003","90","","1771.8","0.4","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- As4 Cd5 H10 O20 -","- As4 Cd5 O20 -","- As16 Cd20 O80 -","4","0.5","","Christopher D. Johnson; Janet M. S. Skakle; Magnus G. Johnston; Jörg Feldmann; Donald E. Macphee","Hydrothermal synthesis, crystal structure and aqueous stability of two cadmium arsenate phases, CdNH4(HAsO4)OH and Cd5H2(AsO4)4·4H2O","J. Mater. Chem.","2003","13","6","1429","1432","10.1039/b302154h","","","0.6928","synchrotron","","0.0401","0.0398","","","0.0984","0.0988","","","","","","1.212","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204630","7.5296","0.0009","6.6592","0.0008","10.1513","0.0012","90","","94.46","0.002","90","","507.46","0.1","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","pyridinium trivanadate heptaoxide","","- C5 H6 N O7 V3 -","- C5 H6 N O7 V3 -","- C10 H12 N2 O14 V6 -","2","1","","Lutta, Samuel T.; Chernova, Natasha A.; Zavalij, Peter Y.; Whittingham, M. Stanley","Solvothermal synthesis and characterization of a layered pyridinium vanadate, (C5H6N)V3O7","Journal of Materials Chemistry","2003","13","6","1424","","10.1039/b302534a","","","0.71073","MoKα","","0.0491","0.0406","","","0.0934","0.0984","","","","","","1.018","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204633","19.66","0.005","16.984","0.005","10.086","0.003","90","","104.492","0.005","90","","3260.6","1.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H47 In N3 S6 -","- C24 H47 In N3 S6 -","- C96 H188 In4 N12 S24 -","4","1","","Park, Jin-Ho; Afzaal, Mohammad; Kemmler, Michael; O'Brien, Paul; Otway, David J.; Raftery, Jim; Waters, John","The deposition of thin films of CuME2 by CVD techniques (M = In, Ga and E = S, Se)","Journal of Materials Chemistry","2003","13","8","1942","","10.1039/b302896h","","","0.71073","MoKα","","0.108","0.0679","","","0.1623","0.1822","","","","","","1.091","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204635","5.362","0.0011","6.145","0.0012","20.668","0.004","86.23","0.03","88.2","0.03","68.4","0.03","631.8","0.3","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H14 S14 -","- C18 H14 S14 -","- C18 H14 S14 -","1","0.5","","Zou, Lei; Xu, Wei; Jia, Chunyang; Zhang, Deqing; Wang, Quanrui; Zhu, Daoben","Cation radical salts of ethylenedisulfanyl-bridged dimeric ethylenedithiotetrathiafulvalene with 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (TCNQF4), PF6?, AsF6?and BF4?: synthesis, structure and conducting properties","Journal of Materials Chemistry","2003","13","7","1646","","10.1039/b303102k","","","0.71073","MoKα","","0.0588","0.0452","","","0.1055","0.109","","","","","","0.929","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204636","8.5358","0.0017","12.105","0.002","12.197","0.002","67.7","0.03","89.67","0.03","79.61","0.03","1144.2","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H14 F8 N8 S14 -","- C42 H14 F8 N8 S14 -","- C42 H14 F8 N8 S14 -","1","0.5","","Zou, Lei; Xu, Wei; Jia, Chunyang; Zhang, Deqing; Wang, Quanrui; Zhu, Daoben","Cation radical salts of ethylenedisulfanyl-bridged dimeric ethylenedithiotetrathiafulvalene with 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (TCNQF4), PF6?, AsF6?and BF4?: synthesis, structure and conducting properties","Journal of Materials Chemistry","2003","13","7","1646","","10.1039/b303102k","","","0.71073","MoKα","","0.1295","0.0612","","","0.143","0.193","","","","","","0.91","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204637","7.62","0.0015","13.024","0.003","15.709","0.003","97.76","0.03","96.96","0.03","101.04","0.03","1498.7","0.6","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C18.5 H15 Cl F6 P S14 -","- C18.5 H14 Cl F6 P S14 -","- C37 H28 Cl2 F12 P2 S28 -","2","1","","Zou, Lei; Xu, Wei; Jia, Chunyang; Zhang, Deqing; Wang, Quanrui; Zhu, Daoben","Cation radical salts of ethylenedisulfanyl-bridged dimeric ethylenedithiotetrathiafulvalene with 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (TCNQF4), PF6?, AsF6?and BF4?: synthesis, structure and conducting properties","Journal of Materials Chemistry","2003","13","7","1646","","10.1039/b303102k","","","0.71073","MoKα","","0.0779","0.0427","","","0.0897","0.1145","","","","","","0.955","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204638","7.83","0.0016","13.263","0.003","15.691","0.003","97.26","0.03","99.53","0.03","100.75","0.03","1557.9","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18.5 H15 As Cl F6 S14 -","- C18.5 H14 As Cl F6 S14 -","- C37 H28 As2 Cl2 F12 S28 -","2","1","","Zou, Lei; Xu, Wei; Jia, Chunyang; Zhang, Deqing; Wang, Quanrui; Zhu, Daoben","Cation radical salts of ethylenedisulfanyl-bridged dimeric ethylenedithiotetrathiafulvalene with 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (TCNQF4), PF6?, AsF6?and BF4?: synthesis, structure and conducting properties","Journal of Materials Chemistry","2003","13","7","1646","","10.1039/b303102k","","","0.71073","MoKα","","0.0785","0.0453","","","0.1062","0.1139","","","","","","0.938","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204639","7.5666","0.0015","28.34","0.006","13.239","0.003","90","","104.09","0.03","90","","2753.5","1.1","123","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 B F4 S14 -","- C18 H14 B F4 S14 -","- C72 H56 B4 F16 S56 -","4","1","","Zou, Lei; Xu, Wei; Jia, Chunyang; Zhang, Deqing; Wang, Quanrui; Zhu, Daoben","Cation radical salts of ethylenedisulfanyl-bridged dimeric ethylenedithiotetrathiafulvalene with 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (TCNQF4), PF6?, AsF6?and BF4?: synthesis, structure and conducting properties","Journal of Materials Chemistry","2003","13","7","1646","","10.1039/b303102k","","","0.71073","MoKα","","0.0849","0.0404","","","0.0635","0.0689","","","","","","0.784","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204641","7.4704","0.0004","8.5931","0.0005","9.3","0.0006","114.805","0.002","93.823","0.002","114.385","0.002","472.35","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C2 H7 N O8 Se3 Zn -","- C2 H7 N O8 Se3 Zn -","- C4 H14 N2 O16 Se6 Zn2 -","2","1","","Udayakumar, D.; Rao, C. N. R.","Organically templated three-dimensional open-framework metal selenites with a diamondoid network","Journal of Materials Chemistry","2003","13","7","1635","","10.1039/b303323f","","","0.71073","MoKα","","0.045","0.0416","","0.107","0.1057","","","","1.032","1.086","1.086","","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204647","8.692","0.001","7.562","0.001","13.034","0.003","90","","102.53","0.01","90","","836.3","0.2","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-bis(2-methoxyphenyl)-3,6-dimethylpyrazine","","- C20 H20 N2 O2 -","- C20 H20 N2 O2 -","- C40 H40 N4 O4 -","2","0.5","","Figen Türksoy; Gregory Hughes; Andrei S. Batsanov; Martin R. Bryce","Phenylene‒2,5-dimethylpyrazine co-oligomers: synthesis by Suzuki couplings, X-ray structures of neutral and diprotonated teraryl species and efficient blue emission","J. Mater. Chem.","2003","13","7","1554","1557","10.1039/b303472k","","","0.71073","MoKα","","0.0604","0.048","","","0.136","0.1466","","","","","","1.074","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204648","6.863","0.001","8.088","0.001","10.548","0.002","67.82","0.01","80.11","0.01","80.11","0.01","530.43","0.15","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","2,5-bis(2-methoxyphenyl)-3,6-dimethylpyrazinium bis(tetrafluoroborate) salt","","- C20 H22 B2 F8 N2 O2 -","- C20 H22 B2 F8 N2 O2 -","- C20 H22 B2 F8 N2 O2 -","1","0.5","","Figen Türksoy; Gregory Hughes; Andrei S. Batsanov; Martin R. Bryce","Phenylene‒2,5-dimethylpyrazine co-oligomers: synthesis by Suzuki couplings, X-ray structures of neutral and diprotonated teraryl species and efficient blue emission","J. Mater. Chem.","2003","13","7","1554","1557","10.1039/b303472k","","","0.71073","MoKα","","0.0937","0.0563","","","0.1068","0.1222","","","","","","1.04","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204649","3.803","0.001","23.231","0.007","8.955","0.003","90","","101.21","0.01","90","","776.1","0.4","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,5-bis(6-methoxypyridin-3-yl)-3,6-dimethylpyrazine","","- C18 H18 N4 O2 -","- C18 H18 N4 O2 -","- C36 H36 N8 O4 -","2","0.5","","Figen Türksoy; Gregory Hughes; Andrei S. Batsanov; Martin R. Bryce","Phenylene‒2,5-dimethylpyrazine co-oligomers: synthesis by Suzuki couplings, X-ray structures of neutral and diprotonated teraryl species and efficient blue emission","J. Mater. Chem.","2003","13","7","1554","1557","10.1039/b303472k","","","0.71073","MoKα","","0.0498","0.0401","","","0.0988","0.1036","","","","","","1.028","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204654","14.6797","0.0006","10.1204","0.0004","16.6015","0.0007","90","","90","","90","","2466.39","0.17","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","methylammonium zinc phosphate","","","- C H6 N O12 P3 Zn4 -","- C H6 N O12 P3 Zn4 -","- C8 H48 N8 O96 P24 Zn32 -","8","1","","Song, Yanning; Zavalij, Peter Y.; Whittingham, M. Stanley","Two novel open-framework zinc phosphates: (CH3NH3)Zn4(PO4)3 and (CH3NH3)2Zn5(PO4)4Electronic supplementary information (ESI) available: tables for atomic coordinates and anisotropic parameters and full list of bond lengths and bond angles. See http://www.rsc.org/suppdata/jm/b3/b303910b/","Journal of Materials Chemistry","2003","13","8","1936","","10.1039/b303910b","","","0.71073","MoKα","","0.0274","0.024","","","0.0542","0.0555","","","","","","1.043","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204655","7.259","0.0019","13.407","0.004","18.031","0.005","90","","90","","90","","1754.8","0.8","296","","296","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","methylammonium zinc phosphate","","","- C2 H12 N2 O16 P4 Zn5 -","- C2 H12 N2 O16 P4 Zn5 -","- C8 H48 N8 O64 P16 Zn20 -","4","1","","Song, Yanning; Zavalij, Peter Y.; Whittingham, M. Stanley","Two novel open-framework zinc phosphates: (CH3NH3)Zn4(PO4)3 and (CH3NH3)2Zn5(PO4)4Electronic supplementary information (ESI) available: tables for atomic coordinates and anisotropic parameters and full list of bond lengths and bond angles. See http://www.rsc.org/suppdata/jm/b3/b303910b/","Journal of Materials Chemistry","2003","13","8","1936","","10.1039/b303910b","","","0.71073","MoKα","","0.0848","0.0774","","","0.1765","0.1805","","","","","","1.095","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204656","5.6139","0.0005","11.0646","0.0012","11.2402","0.0011","92.489","0.008","91.835","0.006","101.208","0.007","683.65","0.12","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H44 N2 O4 -","- C30 H44 N2 O4 -","- C30 H44 N2 O4 -","1","0.5","","Van Deun, Rik; Parac-Vogt, Tatjana N.; Van Hecke, Kristof; Van Meervelt, Luc; Binnemans, Koen; Guillon, Daniel; Donnio, Bertrand","Liquid-crystalline azines formed by the rare-earth promoted decomposition of hydrazide ?habbe? ligands: structural and thermal properties","Journal of Materials Chemistry","2003","13","7","1639","","10.1039/b303941m","","","1.54178","CuK\α","","0.0779","0.0679","","","0.1847","0.1986","","","","","","0.988","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204657","9.6992","0.0009","12.5318","0.0014","14.6417","0.0015","77.935","0.007","88.098","0.009","71.147","0.008","1645.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C82 H52 Cl4 O12 -","- C82 H52 Cl4 O12 -","- C82 H52 Cl4 O12 -","1","0.5","","Howard M. Colquhoun; Mikhail G. Zolotukhin; Lionel G. Sestiaa; Fabio Aricó; Zhixue Zhu; Philip Hodge; Abderrazak Ben-Haida; David J. Williams","Microfabrication of high-performance aromatic polymers as nanotubes or fibrils by in situ ring-opening polymerisation of macrocyclic precursors","J. Mater. Chem.","2003","13","7","1504","1506","10.1039/b303948j","","","1.54178","CuKα","","0.0644","0.0509","","0.1492","0.1347","","","","1.037","1.063","1.063","","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204658","9.461","0.0008","8.3565","0.0007","9.477","0.001","90","","99.908","0.009","90","","738.08","0.12","293","","293","","","","","","","","synthesis described in paper","5","P 1 21/a 1","-P 2yab","14","","ammonium manganese(II) pyrophosphate hydrate","","- H12 Mn3 N2 O16 P4 -","- H12 Mn3 N2 O16 P4 -","- H24 Mn6 N4 O32 P8 -","2","0.5","","Chippindale, Ann M.; Gaslain, Fabrice O. M.; Bond, Andrew D.; Powell, Anthony V.","Synthesis, structure and magnetic characterisation of a new layered ammonium manganese(ii) diphosphate hydrate, (NH4)2[Mn3(P2O7)2(H2O)2]Electronic supplementary information (ESI) available: powder XRD data, atomic coordinates and thermal parameters, IR data, bond valence calculations, TGA. See http://www.rsc.org/suppdata/jm/b3/b304003h/","Journal of Materials Chemistry","2003","13","8","1950","","10.1039/b304003h","","","1.5418","CuKα","","","0.0351","","","","0.0411","","","","","","1.1285","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204672","9.3444","0.0015","16.03","0.003","17.888","0.003","90","","91.768","0.004","90","","2678.2","0.8","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H42 N2 O6 Zr -","- C22 H42 N2 O6 Zr -","- C88 H168 N8 O24 Zr4 -","4","1","","Patil, Urmila; Winter, Manuela; Becker, Hans-Werner; Devi, Anjana","Synthesis and structure of mixed isopropoxide–β-ketoester and β-ketoamide zirconium complexes: Potential precursors for MOCVD of ZrO~2~","Journal of Materials Chemistry","2003","13","9","2177","2184","10.1039/b304419j","","","0.71073","MoKα","","0.0374","0.03","","","0.0777","0.0825","","","","","","1.054","","","","has coordinates","275116","2022-05-06","16:09:05",""
"7204673","9.85","0.02","15.4","0.03","18.71","0.03","90","","97.15","0.05","90","","2816","9","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H40 O8 Zr -","- C22 H40 O8 Zr -","- C88 H160 O32 Zr4 -","4","0.5","","Patil, Urmila; Winter, Manuela; Becker, Hans-Werner; Devi, Anjana","Synthesis and structure of mixed isopropoxide–β-ketoester and β-ketoamide zirconium complexes: Potential precursors for MOCVD of ZrO~2~","Journal of Materials Chemistry","2003","13","9","2177","2184","10.1039/b304419j","","","0.71073","MoKα","","0.0736","0.0638","","","0.1577","0.1655","","","","","","1.131","","","","has coordinates,has disorder","275116","2022-05-06","16:09:05",""
"7204674","10.977","0.003","13.192","0.004","16.218","0.005","74.74","0.02","89.86","0.02","89.86","0.03","2265.7","1.2","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H68 O12 Zr2 -","- C34 H68 O12 Zr2 -","- C68 H136 O24 Zr4 -","2","1","","Patil, Urmila; Winter, Manuela; Becker, Hans-Werner; Devi, Anjana","Synthesis and structure of mixed isopropoxide–β-ketoester and β-ketoamide zirconium complexes: Potential precursors for MOCVD of ZrO~2~","Journal of Materials Chemistry","2003","13","9","2177","2184","10.1039/b304419j","","","0.71073","MoKα","","0.1133","0.0693","","","0.189","0.2415","","","","","","1.037","","","","has coordinates","275116","2022-05-06","16:09:05",""
"7204681","15.0502","0.0006","15.0545","0.0006","21.5114","0.0004","90","","89.962","0.004","90","","4873.9","0.3","","","","","","","","","","","","3","P 1 c 1","P -2yc","7","","","","?","- Bi64 O224 Sn64 -","- Bi64 O224 Sn64 -","","","","Evans, Ivana Radosavljevic; Howard, Judith A. K.; Evans, John S. O.","?-Bi2Sn2O7 ? a 176 atom crystal structure from powder diffraction data","Journal of Materials Chemistry","2003","13","9","2098","","10.1039/b305211g","","","","","","","","","","","","","","","","","","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204689","18.4262","0.0011","20.7941","0.0012","21.1986","0.0012","90","","90","","90","","8122.4","0.8","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H71 Hf N O4 Si4 -","- C28 H71 Hf N O4 Si4 -","- C224 H568 Hf8 N8 O32 Si32 -","8","1","","Roberts, John L.; Marshall, Paul A.; Jones, Anthony C.; Chalker, Paul R.; Bickley, Jamie F.; Williams, Paul A.; Taylor, Stephen; Smith, Lesley M.; Critchlow, Gary W.; Schumacher, Marcus; Lindner, Johannes","Deposition of hafnium silicate films by liquid injection MOCVD using a single source or dual source approach","Journal of Materials Chemistry","2004","14","3","391","","10.1039/b305665c","","","0.71073","MoKα","","0.0475","0.0272","","","0.0586","0.0644","","","","","","1.02","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204693","5.7222","0.0005","4.9314","0.0003","6.8872","0.0004","90","","98.786","0.004","90","","192.07","0.02","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","zn2(oh)bo3","","","- B H O4 Zn2 -","- B O4 Zn2 -","- B2 O8 Zn4 -","2","1","","Yu, Zhen-Tao; Xu, Jin-Jie; Jiang, Yu-Sheng; Shi, Zhan; Guo, Ying; Wang, De-Jun; Chen, Jie-Sheng","Photoluminescent and photovoltaic properties observed in a zinc borate Zn2(OH)BO3Electronic supplementary information (ESI) available: Crystallographic details and ORTEP plot of the asymmetric unit of Zn2(OH)BO3. XPS and IR spectra and DT?TGA curves for Zn2(OH)BO3. See http://www.rsc.org/suppdata/jm/b3/b305968e/","Journal of Materials Chemistry","2003","13","9","2227","","10.1039/b305968e","","","0.71073","MoKα","","0.029","0.0287","","","0.0714","0.0716","","","","","","1.108","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204694","9.814","0.003","11.804","0.003","12.086","0.003","69.327","0.004","85.781","0.004","70.693","0.004","1234.8","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H37 Co O8 Ta -","- C17 H27 Co O8 Ta -","- C34 H54 Co2 O16 Ta2 -","2","1","","Werndrup, Pia; Verdenelli, Martine; Chassagneux, Fernand; Parola, Stephane; Kessler, Vadim G.","Powders and dense thin films of late transition metal oxide nanocomposites from structurally characterized single-source precursorsElectronic supplementary information (ESI) available: further figures and crystallographic details. See http://www.rsc.org/suppdata/jm/b3/b306282a/","Journal of Materials Chemistry","2004","14","3","344","","10.1039/b306282a","","","0.71073","MoKα","","0.0818","0.0605","","","0.1312","0.1351","","","","","","0.868","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204695","8.47","0.002","14.687","0.004","14.815","0.004","90","","90.047","0.005","90","","1843","0.8","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H27 O6 Ta -","- C13 H27 O6 Ta -","- C52 H108 O24 Ta4 -","4","1","","Werndrup, Pia; Verdenelli, Martine; Chassagneux, Fernand; Parola, Stephane; Kessler, Vadim G.","Powders and dense thin films of late transition metal oxide nanocomposites from structurally characterized single-source precursorsElectronic supplementary information (ESI) available: further figures and crystallographic details. See http://www.rsc.org/suppdata/jm/b3/b306282a/","Journal of Materials Chemistry","2004","14","3","344","","10.1039/b306282a","","","0.71073","MoKα","","0.1078","0.0514","","","0.1177","0.1323","","","","","","0.941","","","","has coordinates","180377","2020-10-21","18:00:00",""
"7204696","11.3962","0.0001","11.9752","0.0001","28.0596","0.0004","81.8236","0.0005","86.7661","0.0004","86.6659","0.0008","3779.51","0.07","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H54 Bi N3 Se6 -","- C27 H54 Bi N3 Se6 -","- C108 H216 Bi4 N12 Se24 -","4","2","","Monteiro, Olinda C.; Trindade, Tito; Paz, Filipe A. Almeida; Klinowski, Jacek; Waters, John; O'Brien, Paul","Aerosol-assisted metallo-organic chemical vapour deposition of Bi2Se3 films using single-molecule precursors. The crystal structure of bismuth(iii) dibutyldiselenocarbamate","Journal of Materials Chemistry","2003","13","12","3006","","10.1039/b306662m","","","0.71073","MoKα","","0.0867","0.0585","","","0.1305","0.1477","","","","","","1.035","","","","has coordinates,has disorder","180377","2020-10-21","18:00:00",""
"7204711","6.592","0.002","6.592","0.002","6.592","0.002","90","","90","","90","","286.45","0.15","293","2","293","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Ag2 Li Sn -","- Ag2 Li Sn -","- Ag8 Li4 Sn4 -","4","0.0208333","","Zhiyun Wu; Rolf-Dieter Hoffmann; Dirk Johrendt; Bernd D. Mosel; Hellmut Eckert; Rainer Pöttgen","Electronic structure, physical properties and ionic mobility of LiAg2Sn","J. Mater. Chem.","2003","13","10","2561","2565","10.1039/b306855m","","","0.71073","MoKα","","0.0158","0.0154","","","0.0445","0.045","","","","","","1.203","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204712","8.457","0.002","18.553","0.004","13.006","0.003","90","","90","","90","","2040.7","0.8","150","2","150","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C21 H18 O6 S3 -","- C21 H18 O6 S3 -","- C84 H72 O24 S12 -","4","0.5","","Tahir Khan; Joseph J. W. McDouall; Eric J. L. McInnes; Peter J. Skabara; Pierre Frère; Simon J. Coles; Michael B. Hursthouse","A combined substituent and supramolecular approach for improving the electron donor properties of 1,3-dithiole-2-thione derivatives","J. Mater. Chem.","2003","13","10","2490","2498","10.1039/b307025e","","","0.71073","MoKα","","0.0622","0.053","","","0.1679","0.1758","","","","","","1.423","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204713","9.913","0.002","10.263","0.002","10.766","0.002","94.82","0.03","111.22","0.03","107.38","0.03","951.4","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H18 O6 S2 -","- C21 H18 O6 S2 -","- C42 H36 O12 S4 -","2","1","","Tahir Khan; Joseph J. W. McDouall; Eric J. L. McInnes; Peter J. Skabara; Pierre Frère; Simon J. Coles; Michael B. Hursthouse","A combined substituent and supramolecular approach for improving the electron donor properties of 1,3-dithiole-2-thione derivatives","J. Mater. Chem.","2003","13","10","2490","2498","10.1039/b307025e","","","0.71073","MoKα","","0.0769","0.0459","","","0.1183","0.1416","","","","","","0.879","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204714","7.9335","0.0016","11.415","0.002","14.062","0.003","76.79","0.03","83.82","0.03","89.09","0.03","1232.5","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H20 N2 O5 S3 -","- C27 H20 N2 O5 S3 -","- C54 H40 N4 O10 S6 -","2","1","","Tahir Khan; Joseph J. W. McDouall; Eric J. L. McInnes; Peter J. Skabara; Pierre Frère; Simon J. Coles; Michael B. Hursthouse","A combined substituent and supramolecular approach for improving the electron donor properties of 1,3-dithiole-2-thione derivatives","J. Mater. Chem.","2003","13","10","2490","2498","10.1039/b307025e","","","0.71073","MoKα","","0.1334","0.0627","","","0.124","0.1488","","","","","","0.965","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204724","5.521","0.0008","11.8274","0.0017","5.525","0.0008","90","","107.257","0.002","90","","344.54","0.09","293","2","293","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Lanthanum antimony oxide","","- La O9 Sb3 -","- La O9 Sb3 -","- La2 O18 Sb6 -","2","0.5","","Ok, Kang Min; Gittens, Alex; Zhang, Lei; Halasyamani, P. Shiv","Synthesis, structure and characterization of two new antimony oxides?LaSb3O9 and LaSb5O12: Formation of LaSb5O12 from the reaction of LaSb3O9 with Sb2O3Electronic supplementary information (ESI) available: Powder X-ray diffraction patterns (calculated and experimental). See http://www.rsc.org/suppdata/jm/b3/b307496j/","Journal of Materials Chemistry","2004","14","1","116","","10.1039/b307496j","","","0.71073","MoKα","","0.0484","0.0475","","","0.135","0.1357","","","","","","1.304","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204725","7.2707","0.0007","7.2707","0.0007","16.4673","0.0012","90","","90","","120","","753.89","0.12","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Lanthanum antimony oxide","","- La O12 Sb5 -","- La O12 Sb5 -","- La3 O36 Sb15 -","3","0.0833333","","Ok, Kang Min; Gittens, Alex; Zhang, Lei; Halasyamani, P. Shiv","Synthesis, structure and characterization of two new antimony oxides?LaSb3O9 and LaSb5O12: Formation of LaSb5O12 from the reaction of LaSb3O9 with Sb2O3Electronic supplementary information (ESI) available: Powder X-ray diffraction patterns (calculated and experimental). See http://www.rsc.org/suppdata/jm/b3/b307496j/","Journal of Materials Chemistry","2004","14","1","116","","10.1039/b307496j","","","0.71073","MoKα","","0.023","0.023","","","0.0596","0.0596","","","","","","1.481","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204726","7.4164","0.0002","11.0544","0.0003","10.6791","0.0004","90","","105.361","0.001","90","","844.24","0.05","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H2 Br2 S3 -","- C5 H2 Br2 S3 -","- C20 H8 Br8 S12 -","4","1","","Spencer, Howard J.; Berridge, Rory; Crouch, David J.; Wright, Shaun P.; Giles, Mark; McCulloch, Iain; Coles, Simon J.; Hursthouse, Michael B.; Skabara, Peter J.","Further evidence for spontaneous solid-state polymerisation reactions in 2,5-dibromothiophene derivativesElectronic supplementary information (ESI) available: X-ray data for DBMDTT, DBEDTT and DBPDTT. See http://www.rsc.org/suppdata/jm/b3/b307575n/","Journal of Materials Chemistry","2003","13","9","2075","","10.1039/b307575n","","","0.71073","MoKα","","0.0615","0.0572","","","0.1455","0.1516","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204727","13.1863","0.0004","5.1102","0.0002","14.3454","0.0004","90","","105.854","0.002","90","","929.89","0.05","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H4 Br2 S3 -","- C6 H4 Br2 S3 -","- C24 H16 Br8 S12 -","4","1","","Spencer, Howard J.; Berridge, Rory; Crouch, David J.; Wright, Shaun P.; Giles, Mark; McCulloch, Iain; Coles, Simon J.; Hursthouse, Michael B.; Skabara, Peter J.","Further evidence for spontaneous solid-state polymerisation reactions in 2,5-dibromothiophene derivativesElectronic supplementary information (ESI) available: X-ray data for DBMDTT, DBEDTT and DBPDTT. See http://www.rsc.org/suppdata/jm/b3/b307575n/","Journal of Materials Chemistry","2003","13","9","2075","","10.1039/b307575n","","","0.71073","MoKα","","0.0442","0.0402","","","0.1034","0.1064","","","","","","1.052","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204728","8.7028","0.0002","9.1688","0.0003","15.066","0.0005","75.457","0.001","89.666","0.002","64.081","0.002","1039.13","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H6 Br2 S3 -","- C7 H6 Br2 S3 -","- C28 H24 Br8 S12 -","4","2","","Spencer, Howard J.; Berridge, Rory; Crouch, David J.; Wright, Shaun P.; Giles, Mark; McCulloch, Iain; Coles, Simon J.; Hursthouse, Michael B.; Skabara, Peter J.","Further evidence for spontaneous solid-state polymerisation reactions in 2,5-dibromothiophene derivativesElectronic supplementary information (ESI) available: X-ray data for DBMDTT, DBEDTT and DBPDTT. See http://www.rsc.org/suppdata/jm/b3/b307575n/","Journal of Materials Chemistry","2003","13","9","2075","","10.1039/b307575n","","","0.71073","MoKα","","0.0587","0.052","","","0.1334","0.1391","","","","","","1.019","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204736","15.013","0.001","9.462","0.001","13.355","0.001","90","","109.64","0.01","90","","1786.7","0.3","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","AcOPM-BTTF","4-(4-acetoxyphenyl)-5-methyl-4',5'benzotetrathiafulvalene","","- C19 H14 O2 S4 -","- C19 H14 O2 S4 -","- C76 H56 O8 S16 -","4","1","","Kaboub, Lakhemici; Legros, Jean-Pierre; Donnadieu, Bruno; Gouasmia, Abdel-Krim; Boudiba, Louiza; Fabre, Jean-Marc","Structural study and electrical conductivity of salts based on functionalized TTF containing peripheral selenium atomsElectronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams and a table of selected torsion angles for Ic?e and (Ic)2?TCNQ. See http://www.rsc.org/suppdata/jm/b3/b308514g/","Journal of Materials Chemistry","2004","14","3","351","","10.1039/b308514g","","","0.71073","MoKα","","0.0545","0.0503","","","0.1332","0.138","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204737","6.641","0.002","23.033","0.005","13.83","0.003","90","","101.19","0.02","90","","2075.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","AcOPM-PDSTTF","4-(4-acetoxyphenyl)-5-methyl-4',5'propylenediselenotetrathiafulvalene","","- C18 H16 O2 S4 Se2 -","- C18 H16 O2 S4 Se2 -","- C72 H64 O8 S16 Se8 -","4","1","","Kaboub, Lakhemici; Legros, Jean-Pierre; Donnadieu, Bruno; Gouasmia, Abdel-Krim; Boudiba, Louiza; Fabre, Jean-Marc","Structural study and electrical conductivity of salts based on functionalized TTF containing peripheral selenium atomsElectronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams and a table of selected torsion angles for Ic?e and (Ic)2?TCNQ. See http://www.rsc.org/suppdata/jm/b3/b308514g/","Journal of Materials Chemistry","2004","14","3","351","","10.1039/b308514g","","","0.71069","MoKα","","0.1229","0.0325","","","0.0995","0.1262","","","","","","0.964","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204738","10.453","0.001","17.267","0.002","11.518","0.001","90","","112.1","0.01","90","","1926.2","0.4","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","AcOPM-EDSTTF","4-(4-acetoxyphenyl)-5-methyl-4',5'ethylenediselenotetrathiafulvalene","","- C17 H14 O2 S4 Se2 -","- C17 H14 O2 S4 Se2 -","- C68 H56 O8 S16 Se8 -","4","1","","Kaboub, Lakhemici; Legros, Jean-Pierre; Donnadieu, Bruno; Gouasmia, Abdel-Krim; Boudiba, Louiza; Fabre, Jean-Marc","Structural study and electrical conductivity of salts based on functionalized TTF containing peripheral selenium atomsElectronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams and a table of selected torsion angles for Ic?e and (Ic)2?TCNQ. See http://www.rsc.org/suppdata/jm/b3/b308514g/","Journal of Materials Chemistry","2004","14","3","351","","10.1039/b308514g","","","0.71073","MoKα","","0.047","0.0357","","","0.095","0.0998","","","","","","1.1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204739","30.154","0.008","4.052","0.004","39.317","0.009","90","","91.4","0.03","90","","4802","5","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","(AcOPM-EDSTTF)2-TCNQ","","","- C23 H16 N2 O2 S4 Se2 -","- C23 H16 N2 O2 S4 Se2 -","- C184 H128 N16 O16 S32 Se16 -","8","1","","Kaboub, Lakhemici; Legros, Jean-Pierre; Donnadieu, Bruno; Gouasmia, Abdel-Krim; Boudiba, Louiza; Fabre, Jean-Marc","Structural study and electrical conductivity of salts based on functionalized TTF containing peripheral selenium atomsElectronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams and a table of selected torsion angles for Ic?e and (Ic)2?TCNQ. See http://www.rsc.org/suppdata/jm/b3/b308514g/","Journal of Materials Chemistry","2004","14","3","351","","10.1039/b308514g","","","0.71073","MoKα","","0.1119","0.0484","","","0.1073","0.1309","","","","","","1.028","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204744","8.0797","0.0018","14.555","0.003","28.575","0.007","90","","90","","90","","3360.4","1.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Zinc phosphate","","","- C3 H14 N2 O11 P2 Zn -","- C3 H14 N2 O11 P2 Zn -","- C24 H112 N16 O88 P16 Zn8 -","8","1","","Neeraj, S.; Rao, C. N. R.; Cheetham, Anthony K.","Open-framework zinc and cobalt phosphates synthesized by the tributylphosphate routeElectronic supplementary information (ESI) available: Tables S1?16: Atomic coordinates, equivalent isotropic displacement parameters and bond lengths and angles for compounds I?VII. See http://www.rsc.org/suppdata/jm/b3/b311529a/","Journal of Materials Chemistry","2004","14","5","814","","10.1039/b311529a","","","0.71073","MoKα","","0.1858","0.1024","","","0.2678","0.331","","","","","","1.003","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204745","20.7603","0.0012","5.2207","0.0003","17.9147","0.001","90","","90","","90","","1941.65","0.19","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","Zinc Phosphate","","","- C4 H16 N2 O17 P4 Zn5 -","- C4 H15 N2 O17 P4 Zn5 -","- C16 H60 N8 O68 P16 Zn20 -","4","1","","Neeraj, S.; Rao, C. N. R.; Cheetham, Anthony K.","Open-framework zinc and cobalt phosphates synthesized by the tributylphosphate routeElectronic supplementary information (ESI) available: Tables S1?16: Atomic coordinates, equivalent isotropic displacement parameters and bond lengths and angles for compounds I?VII. See http://www.rsc.org/suppdata/jm/b3/b311529a/","Journal of Materials Chemistry","2004","14","5","814","","10.1039/b311529a","","","0.71073","MoKα","","0.039","0.0353","","","0.0818","0.0832","","","","","","1.017","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204746","5.04","0.0009","9.584","0.003","13.117","0.002","101.094","0.019","100.931","0.019","103.598","0.018","585.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Zinc Phosphate","","","- H2 N0.5 O13 P3 Zn4 -","- N0.5 O13 P3 Zn4 -","- N O26 P6 Zn8 -","2","1","","Neeraj, S.; Rao, C. N. R.; Cheetham, Anthony K.","Open-framework zinc and cobalt phosphates synthesized by the tributylphosphate routeElectronic supplementary information (ESI) available: Tables S1?16: Atomic coordinates, equivalent isotropic displacement parameters and bond lengths and angles for compounds I?VII. See http://www.rsc.org/suppdata/jm/b3/b311529a/","Journal of Materials Chemistry","2004","14","5","814","","10.1039/b311529a","","","0.71073","MoKα","","0.0495","0.0456","","","0.1204","0.1228","","","","","","1.134","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204747","11.939","0.002","13.803","0.003","7.9473","0.0015","90","","91.514","0.003","90","","1309.2","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Cobalt Phosphate","","","- C3 H9 Co0.5 N O4 P -","- C3 H9 Co0.5 N O4 P -","- C24 H72 Co4 N8 O32 P8 -","8","1","","Neeraj, S.; Rao, C. N. R.; Cheetham, Anthony K.","Open-framework zinc and cobalt phosphates synthesized by the tributylphosphate routeElectronic supplementary information (ESI) available: Tables S1?16: Atomic coordinates, equivalent isotropic displacement parameters and bond lengths and angles for compounds I?VII. See http://www.rsc.org/suppdata/jm/b3/b311529a/","Journal of Materials Chemistry","2004","14","5","814","","10.1039/b311529a","","","0.71073","MoKα","","0.0384","0.0343","","","0.1059","0.1078","","","","","","1.134","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204748","7.2743","0.0018","23.03","0.006","9.873","0.002","90","","93.131","0.004","90","","1651.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Cobalt Phosphate","","","- C6 H21 Co2 N3 O13 P3 -","- C6 H21 Co2 N3 O13 P3 -","- C24 H84 Co8 N12 O52 P12 -","4","1","","Neeraj, S.; Rao, C. N. R.; Cheetham, Anthony K.","Open-framework zinc and cobalt phosphates synthesized by the tributylphosphate routeElectronic supplementary information (ESI) available: Tables S1?16: Atomic coordinates, equivalent isotropic displacement parameters and bond lengths and angles for compounds I?VII. See http://www.rsc.org/suppdata/jm/b3/b311529a/","Journal of Materials Chemistry","2004","14","5","814","","10.1039/b311529a","","","0.71073","MoKα","","0.0727","0.0501","","","0.1348","0.1464","","","","","","1.03","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204749","9.422","0.0009","9.5705","0.0009","9.931","0.001","90","","90","","90","","895.51","0.15","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- Al2 H10 N2 O10 P2 -","- Al2 H6 N O11 P2 -","- Al8 H24 N4 O44 P8 -","4","1","","M. Eloísa Medina; M. Iglesias; E. Gutiérrez-Puebla; M. Angeles Monge","Solvothermal synthesis and structural relations among three anionic aluminophosphates; catalytic behaviour","J. Mater. Chem.","2004","14","5","845","850","10.1039/b311618b","","","0.71073","MoKα","","0.0395","0.0351","","","0.0842","0.0852","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204750","13.261","0.003","10.255","0.002","8.8627","0.0019","90","","111.407","0.004","90","","1122.1","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Al2 H12 N3 O12 P3 -","- Al2 H12 N3 O12 P3 -","- Al8 H48 N12 O48 P12 -","4","0.5","","M. Eloísa Medina; M. Iglesias; E. Gutiérrez-Puebla; M. Angeles Monge","Solvothermal synthesis and structural relations among three anionic aluminophosphates; catalytic behaviour","J. Mater. Chem.","2004","14","5","845","850","10.1039/b311618b","","","0.71073","MoKα","","0.1375","0.0722","","","0.1237","0.1433","","","","","","0.975","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204751","8.9998","0.0009","9.979","0.001","11.1099","0.0011","90","","90.645","0.002","90","","997.71","0.17","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Al H12 N3 O8 P2 -","- Al H12 N3 O8 P2 -","- Al4 H48 N12 O32 P8 -","4","1","","M. Eloísa Medina; M. Iglesias; E. Gutiérrez-Puebla; M. Angeles Monge","Solvothermal synthesis and structural relations among three anionic aluminophosphates; catalytic behaviour","J. Mater. Chem.","2004","14","5","845","850","10.1039/b311618b","","","0.71073","MoKα","","0.0889","0.0579","","","0.1333","0.1406","","","","","","0.892","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204753","14.0717","0.0011","14.7803","0.0008","17.3186","0.0012","114.918","0.004","92.242","0.006","115.042","0.005","2854.1","0.4","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H84 Ag3 N3 P6 Se6 -","- C36 H84 Ag3 N3 P6 Se6 -","- C72 H168 Ag6 N6 P12 Se12 -","2","1","","Afzaal, Mohammad; Crouch, David J.; O'Brien, Paul; Raftery, James; Skabara, Peter J.; White, Andrew J. P.; Williams, David J.","The synthesis, X-ray structures and CVD studies of some group 11 complexes of iminobis(diisopropylphosphine selenides) and their use in the deposition of I/III/VI photovoltaic materials","Journal of Materials Chemistry","2004","14","2","233","","10.1039/b311743j","","","0.71073","MoKα","","0.061","0.0382","","0.0922","0.0763","","","","1.009","1.061","1.061","","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204754","13.178","0.008","30.108","0.017","14.691","0.009","90","","109.423","0.012","90","","5497","6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H84 Cu3 N3 P6 Se6 -","- C36 H84 Cu3 N3 P6 Se6 -","- C144 H336 Cu12 N12 P24 Se24 -","4","1","","Afzaal, Mohammad; Crouch, David J.; O'Brien, Paul; Raftery, James; Skabara, Peter J.; White, Andrew J. P.; Williams, David J.","The synthesis, X-ray structures and CVD studies of some group 11 complexes of iminobis(diisopropylphosphine selenides) and their use in the deposition of I/III/VI photovoltaic materials","Journal of Materials Chemistry","2004","14","2","233","","10.1039/b311743j","","","0.71073","MoKα","","0.1082","0.0531","","","0.1016","0.1134","","","","","","0.74","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204755","18.2135","0.0011","19.0174","0.0011","22.9457","0.0013","67.153","0.001","67.873","0.001","62.286","0.001","6293.9","0.6","150","1","150","1","","","","","","","","7","P -1","-P 1","2","","","","- C77 H133 Cd11 N10 O2 Te19 Zn5 -","- C77 Cd11 N10 O2 Te19 Zn5 -","- C154 Cd22 N20 O4 Te38 Zn10 -","2","1","","DeGroot, Marty W.; Taylor, Nicholas J.; Corrigan, John F.","Molecular nanocluster analogues of CdSe/ZnSe and CdTe/ZnTe core/shell nanoparticles","Journal of Materials Chemistry","2004","14","4","654","","10.1039/b312297b","","","0.71073","MoKα","","0.1304","0.0685","","","0.1199","0.1336","","","","","","1.13","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204756","17.3933","0.0014","36.592","0.003","46.151","0.004","90","","90","","90","","29373","4","150","1","150","1","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C86 H150 Cd11 N10 O5 Se19 Zn5 -","- C86 Cd11 N10 O5 Se19 Zn5 -","- C688 Cd88 N80 O40 Se152 Zn40 -","8","1","","DeGroot, Marty W.; Taylor, Nicholas J.; Corrigan, John F.","Molecular nanocluster analogues of CdSe/ZnSe and CdTe/ZnTe core/shell nanoparticles","Journal of Materials Chemistry","2004","14","4","654","","10.1039/b312297b","","","0.71073","MoKα","","0.1625","0.0927","","","0.2018","0.2183","","","","","","1.176","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204757","8.0312","0.0016","12.13","0.002","20.777","0.004","102.29","0.03","99.88","0.03","100.13","0.03","1900.3","0.7","200","2","200","2","","","","","","","","6","P -1","-P 1","2","(EDT-TTF-I2)2, PbI3, H20","Bis(3,4-diiodo-3',4'-ethylenedithiotetrathiafulvalene), triiodolead(II), water","","- C8 H4 I3.5 O0.5 Pb0.5 S6 -","- C8 H4 I3.5 O0.5 Pb0.5 S6 -","- C32 H16 I14 O2 Pb2 S24 -","4","2","","Devic, Thomas; Canadell, Enric; Auban-Senzier, Pascale; Batail, Patrick","(EDT-TTF-I2)2PbI3�H2O: an ambient pressure metal with a ?? donor slab topologyElectronic supplementary information (ESI) available: indexed X-ray powder diagram and chemical analysis results for [(C2H5)4N]PbI3. See http://www.rsc.org/suppdata/jm/b3/b312493b/","Journal of Materials Chemistry","2004","14","2","135","","10.1039/b312493b","","","0.71073","MoKα","","0.0496","0.0332","","","0.0765","0.0807","","","","","","0.908","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204758","20.796","0.002","9.7845","0.0011","25.62","0.003","90","","102.013","0.013","90","","5099","1","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H84 N4 Nb2 O12 Sr -","- C34 H84 N4 Nb2 O12 Sr -","- C136 H336 N16 Nb8 O48 Sr4 -","4","1","","Jones, Anthony C.; Tobin, Neil L.; Marshall, Paul A.; Potter, Richard J.; Chalker, Paul R.; Bickley, Jamie F.; Davies, Hywel O.; Smith, Lesley M.; Critchlow, Gary W.","Synthesis and characterisation of four new heterometal alkoxides: potential precursors for the MOCVD of ferroelectric oxides","Journal of Materials Chemistry","2004","14","5","887","","10.1039/b312697h","","","0.71073","MoKα","","0.1507","0.0594","","","0.1213","0.1356","","","","","","0.847","","","","has coordinates,has disorder","180378","2020-10-21","18:00:00",""
"7204759","14.997","0.0019","16.743","0.003","19.587","0.002","90","","90","","90","","4918.2","1.2","213","2","213","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C32 H82 N2 Nb2 O14 Sr -","- C32 H82 N2 Nb2 O14 Sr -","- C128 H328 N8 Nb8 O56 Sr4 -","4","0.5","","Jones, Anthony C.; Tobin, Neil L.; Marshall, Paul A.; Potter, Richard J.; Chalker, Paul R.; Bickley, Jamie F.; Davies, Hywel O.; Smith, Lesley M.; Critchlow, Gary W.","Synthesis and characterisation of four new heterometal alkoxides: potential precursors for the MOCVD of ferroelectric oxides","Journal of Materials Chemistry","2004","14","5","887","","10.1039/b312697h","","","0.71073","MoKα","","0.119","0.0503","","","0.1088","0.1276","","","","","","0.743","","","","has coordinates,has disorder","180378","2020-10-21","18:00:00",""
"7204760","11.7669","0.0012","15.9611","0.0015","16.197","0.0016","61.296","0.002","81.524","0.002","78.748","0.002","2611.8","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H90 N2 O12 Sr Ta2 -","- C38 H90 N2 O12 Sr Ta2 -","- C76 H180 N4 O24 Sr2 Ta4 -","2","1","","Jones, Anthony C.; Tobin, Neil L.; Marshall, Paul A.; Potter, Richard J.; Chalker, Paul R.; Bickley, Jamie F.; Davies, Hywel O.; Smith, Lesley M.; Critchlow, Gary W.","Synthesis and characterisation of four new heterometal alkoxides: potential precursors for the MOCVD of ferroelectric oxides","Journal of Materials Chemistry","2004","14","5","887","","10.1039/b312697h","","","0.71073","MoKα","","0.0507","0.047","","","0.1278","0.133","","","","","","1.026","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204762","14.973","0.002","9.9024","0.0016","20.581","0.003","90","","109.379","0.002","90","","2878.6","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H44 N2 Pb S4 -","- C26 H44 N2 Pb S4 -","- C104 H176 N8 Pb4 S16 -","4","1","","Afzaal, Mohammad; Ellwood, Katie; Pickett, Nigel L.; O'Brien, Paul; Raftery, Jim; Waters, John","Growth of lead chalcogenide thin films using single-source precursors","Journal of Materials Chemistry","2004","14","8","1310","","10.1039/b313063k","","","0.71073","MoKα","","0.0264","0.0243","","","0.0558","0.0569","","","","","","1.055","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204763","15.4819","0.0014","9.9772","0.0009","36.422","0.003","90","","97.51","0.002","90","","5577.7","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H88 N4 Pb2 S8 -","- C44 H88 N4 Pb2 S8 -","- C176 H352 N16 Pb8 S32 -","4","1","","Afzaal, Mohammad; Ellwood, Katie; Pickett, Nigel L.; O'Brien, Paul; Raftery, Jim; Waters, John","Growth of lead chalcogenide thin films using single-source precursors","Journal of Materials Chemistry","2004","14","8","1310","","10.1039/b313063k","","","0.71073","MoKα","","0.0902","0.066","","","0.1448","0.1545","","","","","","1.121","","","","has coordinates,has disorder","180378","2020-10-21","18:00:00",""
"7204764","12.667","0.006","4.874","0.005","22.85","0.01","90","","103.26","0.03","90","","1373.1","1.7","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H11 N O2 S3 -","- C13 H11 N O2 S3 -","- C52 H44 N4 O8 S12 -","4","1","","Bruno Jousselme; Philippe Blanchard; Maïtena Oçafrain; Magali Allain; Eric Levillain; Jean Roncali","Electrogenerated poly(thiophenes) derivatized by bipyridine ligands and metal complexes","J. Mater. Chem.","2004","14","3","421","427","10.1039/b313291a","","","0.71073","Mo-Kα","","0.133","0.043","","0.097","","0.057","","","1.625","","","1.051","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204765","11.679","0.007","7.704","0.002","16.835","0.004","90","","93.35","0.04","90","","1512.1","1.1","294","","294","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C32 H24 N2 O4 S6 -","- C32 H24 N2 O4 S6 -","- C64 H48 N4 O8 S12 -","2","0.5","","Bruno Jousselme; Philippe Blanchard; Maïtena Oçafrain; Magali Allain; Eric Levillain; Jean Roncali","Electrogenerated poly(thiophenes) derivatized by bipyridine ligands and metal complexes","J. Mater. Chem.","2004","14","3","421","427","10.1039/b313291a","","","0.71073","Mo-Kα","","0.076","0.04","","0.072","0.056","","","","1.431","1.179","1.179","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204769","6.0939","0.0013","7.5286","0.0015","12.491","0.003","85.554","0.006","86.479","0.006","84.095","0.006","567.5","0.2","160","2","160","2","","","","","","","","3","P -1","-P 1","2","","Tolan Perfluorotolan 1:1 molecular complex","","- C28 H10 F10 -","- C28 H10 F10 -","- C28 H10 F10 -","1","0.5","","Smith, Caroline E.; Smith, Philip S.; Thomas, Rhodri Ll.; Robins, Edward G.; Collings, Jonathan C.; Dai, Chaoyang; Scott, Andrew J.; Borwick, Simon; Batsanov, Andrei S.; Watt, Stephen W.; Clark, Stewart J.; Viney, Christopher; Howard, Judith A. K.; Clegg, William; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering: structural preferences in polyfluorinated tolansArene?perfluoroarene interactions in crystal engineering. Part 9. Presented in part at the 16th International Symposium on Fluorine Chemistry, University of Durham, 2000. Abstract 1P-102. For part 8 see ref. 1.Electronic supplementary information (ESI) available: spectroscopic characterisation for 4b?k; plots of energy as a function of inter-ring torsion angle in 1,2,3,4,5-pentafluorotolan and as a function of C(Ph)?C(Ph)?O?C(Me) torsion angle in PhOMe. See http://www.rsc.org/suppdata/jm/b3/b314094f/","Journal of Materials Chemistry","2004","14","3","413","","10.1039/b314094f","","","0.71073","MoKα","","0.0961","0.0675","","0.1782","","0.164","","","0.947","","","1.128","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204770","6.1305","0.001","7.2444","0.0012","12.754","0.002","85.229","0.004","84.793","0.004","85.766","0.004","560.88","0.16","160","2","160","2","","","","","","","","3","P -1","-P 1","2","","1-(pentafluorophenyl)-2-phenylacetylene","","- C14 H5 F5 -","- C14 H5 F5 -","- C28 H10 F10 -","2","1","","Smith, Caroline E.; Smith, Philip S.; Thomas, Rhodri Ll.; Robins, Edward G.; Collings, Jonathan C.; Dai, Chaoyang; Scott, Andrew J.; Borwick, Simon; Batsanov, Andrei S.; Watt, Stephen W.; Clark, Stewart J.; Viney, Christopher; Howard, Judith A. K.; Clegg, William; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering: structural preferences in polyfluorinated tolansArene?perfluoroarene interactions in crystal engineering. Part 9. Presented in part at the 16th International Symposium on Fluorine Chemistry, University of Durham, 2000. Abstract 1P-102. For part 8 see ref. 1.Electronic supplementary information (ESI) available: spectroscopic characterisation for 4b?k; plots of energy as a function of inter-ring torsion angle in 1,2,3,4,5-pentafluorotolan and as a function of C(Ph)?C(Ph)?O?C(Me) torsion angle in PhOMe. See http://www.rsc.org/suppdata/jm/b3/b314094f/","Journal of Materials Chemistry","2004","14","3","413","","10.1039/b314094f","","","0.71073","MoKα","","0.0971","0.0623","","0.1767","","0.1584","","","1.059","","","1.213","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204771","7.413","0.002","12.941","0.005","12.868","0.005","90","","100.85","0.02","90","","1212.4","0.7","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-methoxytetrafluorophenyl)-2-phenylacetylene","","- C15 H8 F4 O -","- C15 H8 F4 O -","- C60 H32 F16 O4 -","4","1","","Smith, Caroline E.; Smith, Philip S.; Thomas, Rhodri Ll.; Robins, Edward G.; Collings, Jonathan C.; Dai, Chaoyang; Scott, Andrew J.; Borwick, Simon; Batsanov, Andrei S.; Watt, Stephen W.; Clark, Stewart J.; Viney, Christopher; Howard, Judith A. K.; Clegg, William; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering: structural preferences in polyfluorinated tolansArene?perfluoroarene interactions in crystal engineering. Part 9. Presented in part at the 16th International Symposium on Fluorine Chemistry, University of Durham, 2000. Abstract 1P-102. For part 8 see ref. 1.Electronic supplementary information (ESI) available: spectroscopic characterisation for 4b?k; plots of energy as a function of inter-ring torsion angle in 1,2,3,4,5-pentafluorotolan and as a function of C(Ph)?C(Ph)?O?C(Me) torsion angle in PhOMe. See http://www.rsc.org/suppdata/jm/b3/b314094f/","Journal of Materials Chemistry","2004","14","3","413","","10.1039/b314094f","","","1.54178","CuKα","","0.0596","0.0542","","","0.143","0.1488","","","","","","1.102","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204772","7.752","0.002","8.652","0.002","11.119","0.003","98.57","0.01","108.81","0.01","92.06","0.01","695.2","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","1-(4-n-propoxytetrafluorophenyl)-2-phenylacetylene","","- C17 H12 F4 O -","- C17 H12 F4 O -","- C34 H24 F8 O2 -","2","1","","Smith, Caroline E.; Smith, Philip S.; Thomas, Rhodri Ll.; Robins, Edward G.; Collings, Jonathan C.; Dai, Chaoyang; Scott, Andrew J.; Borwick, Simon; Batsanov, Andrei S.; Watt, Stephen W.; Clark, Stewart J.; Viney, Christopher; Howard, Judith A. K.; Clegg, William; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering: structural preferences in polyfluorinated tolansArene?perfluoroarene interactions in crystal engineering. Part 9. Presented in part at the 16th International Symposium on Fluorine Chemistry, University of Durham, 2000. Abstract 1P-102. For part 8 see ref. 1.Electronic supplementary information (ESI) available: spectroscopic characterisation for 4b?k; plots of energy as a function of inter-ring torsion angle in 1,2,3,4,5-pentafluorotolan and as a function of C(Ph)?C(Ph)?O?C(Me) torsion angle in PhOMe. See http://www.rsc.org/suppdata/jm/b3/b314094f/","Journal of Materials Chemistry","2004","14","3","413","","10.1039/b314094f","","","0.71073","MoKα","","0.0448","0.0403","","","0.1101","0.1154","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204773","6.1278","0.0015","15.444","0.004","15.382","0.003","90","","97.35","0.02","90","","1443.8","0.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-iso-propoxytetrafluorophenyl)-2-phenylacetylene","","- C17 H12 F4 O -","- C17 H12 F4 O -","- C68 H48 F16 O4 -","4","1","","Smith, Caroline E.; Smith, Philip S.; Thomas, Rhodri Ll.; Robins, Edward G.; Collings, Jonathan C.; Dai, Chaoyang; Scott, Andrew J.; Borwick, Simon; Batsanov, Andrei S.; Watt, Stephen W.; Clark, Stewart J.; Viney, Christopher; Howard, Judith A. K.; Clegg, William; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering: structural preferences in polyfluorinated tolansArene?perfluoroarene interactions in crystal engineering. Part 9. Presented in part at the 16th International Symposium on Fluorine Chemistry, University of Durham, 2000. Abstract 1P-102. For part 8 see ref. 1.Electronic supplementary information (ESI) available: spectroscopic characterisation for 4b?k; plots of energy as a function of inter-ring torsion angle in 1,2,3,4,5-pentafluorotolan and as a function of C(Ph)?C(Ph)?O?C(Me) torsion angle in PhOMe. See http://www.rsc.org/suppdata/jm/b3/b314094f/","Journal of Materials Chemistry","2004","14","3","413","","10.1039/b314094f","","","1.54178","CuKα","","0.0503","0.0415","","","0.1219","0.1303","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204774","8.514","0.001","10.454","0.002","10.6","0.002","63.225","0.002","76.621","0.003","85.017","0.003","819.3","0.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","1-(4-n-pentoxytetrafluorophenyl)-2-phenylacetylene","","- C19 H16 F4 O -","- C19 H16 F4 O -","- C38 H32 F8 O2 -","2","1","","Smith, Caroline E.; Smith, Philip S.; Thomas, Rhodri Ll.; Robins, Edward G.; Collings, Jonathan C.; Dai, Chaoyang; Scott, Andrew J.; Borwick, Simon; Batsanov, Andrei S.; Watt, Stephen W.; Clark, Stewart J.; Viney, Christopher; Howard, Judith A. K.; Clegg, William; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering: structural preferences in polyfluorinated tolansArene?perfluoroarene interactions in crystal engineering. Part 9. Presented in part at the 16th International Symposium on Fluorine Chemistry, University of Durham, 2000. Abstract 1P-102. For part 8 see ref. 1.Electronic supplementary information (ESI) available: spectroscopic characterisation for 4b?k; plots of energy as a function of inter-ring torsion angle in 1,2,3,4,5-pentafluorotolan and as a function of C(Ph)?C(Ph)?O?C(Me) torsion angle in PhOMe. See http://www.rsc.org/suppdata/jm/b3/b314094f/","Journal of Materials Chemistry","2004","14","3","413","","10.1039/b314094f","","","0.71073","MoKα","","0.0627","0.0468","","","0.1155","0.1275","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204775","7.918","0.002","5.777","0.002","35.872","0.009","90","","94.32","0.01","90","","1636.2","0.8","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-tolyloxytetrafluorophenyl)-2-phenylacetylene","","- C21 H12 F4 O -","- C21 H12 F4 O -","- C84 H48 F16 O4 -","4","1","","Smith, Caroline E.; Smith, Philip S.; Thomas, Rhodri Ll.; Robins, Edward G.; Collings, Jonathan C.; Dai, Chaoyang; Scott, Andrew J.; Borwick, Simon; Batsanov, Andrei S.; Watt, Stephen W.; Clark, Stewart J.; Viney, Christopher; Howard, Judith A. K.; Clegg, William; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering: structural preferences in polyfluorinated tolansArene?perfluoroarene interactions in crystal engineering. Part 9. Presented in part at the 16th International Symposium on Fluorine Chemistry, University of Durham, 2000. Abstract 1P-102. For part 8 see ref. 1.Electronic supplementary information (ESI) available: spectroscopic characterisation for 4b?k; plots of energy as a function of inter-ring torsion angle in 1,2,3,4,5-pentafluorotolan and as a function of C(Ph)?C(Ph)?O?C(Me) torsion angle in PhOMe. See http://www.rsc.org/suppdata/jm/b3/b314094f/","Journal of Materials Chemistry","2004","14","3","413","","10.1039/b314094f","","","0.71073","MoKα","","0.0467","0.0399","","","0.0934","0.099","","","","","","1.073","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204780","16.466","0.0001","16.466","0.0001","7.7375","0.0001","90","","90","","120","","1816.8","0.03","296","2","296","2","","","","","","","","4","P 63 c m","P 6c -2","185","","","","- C36 H42 Eu2 O12 -","- C36 H42 Eu2 O12 -","- C72 H84 Eu4 O24 -","2","0.166667","","Franck Millange; Christian Serre; Jérôme Marrot; Nicole Gardant; Fabienne Pellé; Gérard Férey","Synthesis, structure and properties of a three-dimensional porous rare-earth carboxylate MIL-83(Eu): Eu2(O2C-C10H14-CO2)3","J. Mater. Chem.","2004","14","4","642","645","10.1039/b314343k","","","0.71073","MoKα","","0.092","0.0727","","","0.1919","0.2153","","","","","","1.125","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204781","6.6032","0.0012","16.986","0.003","20.412","0.004","90","","94.845","0.003","90","","2281.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H24 N4 Nd2 O22 S5 -","- C4 H24 N4 Nd2 O22 S5 -","- C16 H96 N16 Nd8 O88 S20 -","4","1","","Dan, Meenakshi; Behera, J. N.; Rao, C. N. R.","Organically templated rare earth sulfates with three-dimensional and layered structuresElectronic supplementary information (ESI) available: Tables S1?S6. See http://www.rsc.org/suppdata/jm/b3/b314663d/","Journal of Materials Chemistry","2004","14","8","1257","","10.1039/b314663d","","","0.71073","MoKα","","0.0418","0.035","","0.072","0.0696","","","","1.115","1.146","1.146","","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204782","6.621","0.0004","11.7941","0.0006","12.2064","0.0007","90.846","0.001","100.577","0.001","102.446","0.001","913.5","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H16 N2 Nd2 O18 S4 -","- C4 H16 N2 Nd2 O18 S4 -","- C8 H32 N4 Nd4 O36 S8 -","2","1","","Dan, Meenakshi; Behera, J. N.; Rao, C. N. R.","Organically templated rare earth sulfates with three-dimensional and layered structuresElectronic supplementary information (ESI) available: Tables S1?S6. See http://www.rsc.org/suppdata/jm/b3/b314663d/","Journal of Materials Chemistry","2004","14","8","1257","","10.1039/b314663d","","","0.71073","MoKα","","0.0345","0.0283","","0.0679","0.066","","","","0.976","1.037","1.037","","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204783","5.4823","0.0001","7.2328","0.0003","9.7943","0.0004","87.165","0.002","83.125","0.002","80.269","0.002","379.86","0.02","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C H5 N Nd O8 S2 -","- C H5 N Nd O8 S2 -","- C2 H10 N2 Nd2 O16 S4 -","2","1","","Dan, Meenakshi; Behera, J. N.; Rao, C. N. R.","Organically templated rare earth sulfates with three-dimensional and layered structuresElectronic supplementary information (ESI) available: Tables S1?S6. See http://www.rsc.org/suppdata/jm/b3/b314663d/","Journal of Materials Chemistry","2004","14","8","1257","","10.1039/b314663d","","","0.71073","MoKα","","0.0312","0.029","","0.0765","0.075","","","","1.071","1.103","1.103","","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204784","11.1008","0.0007","7.3085","0.0005","20.1323","0.0013","90","","91.829","0.001","90","","1632.51","0.18","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 La2 N2 O16 S4 -","- C3 H12 La2 N2 O16 S4 -","- C12 H48 La8 N8 O64 S16 -","4","1","","Dan, Meenakshi; Behera, J. N.; Rao, C. N. R.","Organically templated rare earth sulfates with three-dimensional and layered structuresElectronic supplementary information (ESI) available: Tables S1?S6. See http://www.rsc.org/suppdata/jm/b3/b314663d/","Journal of Materials Chemistry","2004","14","8","1257","","10.1039/b314663d","","","0.71073","MoKα","","0.0301","0.0239","","0.0666","0.0643","","","","1.082","1.167","1.167","","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7204785","25.506","0.005","10.102","0.002","13.415","0.003","90","","90","","90","","3456.5","1.2","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C7 H24 N3 Nd O13.5 S2.5 -","- C7 H24 N3 Nd O13.5 S2.5 -","- C56 H192 N24 Nd8 O108 S20 -","8","1","","Dan, Meenakshi; Behera, J. N.; Rao, C. N. R.","Organically templated rare earth sulfates with three-dimensional and layered structuresElectronic supplementary information (ESI) available: Tables S1?S6. See http://www.rsc.org/suppdata/jm/b3/b314663d/","Journal of Materials Chemistry","2004","14","8","1257","","10.1039/b314663d","","","0.71073","MoKα","","0.0536","0.0469","","0.0932","0.0913","","","","1.287","1.328","1.328","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204787","12.8276","0.0007","7.4062","0.0004","11.4938","0.0003","90","","100.662","0.005","90","","1073.1","0.09","","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Yttrium Iron Molybdenum Oxide","Yttrium Iron Molybdenum Oxide","","- Fe Mo O7 Y2 -","- Fe1.005 Mo0.995 O7 Y2 -","- Fe8.04 Mo7.96 O56 Y16 -","8","1","","Veith, Gabriel M.; Lobanov, Maxim V.; Emge, Thomas J.; Greenblatt, Martha; Croft, Mark; Stowasser, Frank; Hadermann, Joke; Tendeloo, Gustaaf Van","Synthesis and characterization of the new Ln2FeMoO7 (Ln = Y, Dy, Ho) compounds","Journal of Materials Chemistry","2004","14","10","1623","","10.1039/b315028c","powder diffraction","","","CuKα","","","","","","","","","","1.77","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204788","7.4117","0.0002","7.4117","","16.9197","0.0006","90","","90","","120","","804.93","0.04","","","293","","","","","","","","","4","R -3 :H","-R 3","148","Holmium Iron Molybdenum Oxide","Holmium Iron Molybdenum Oxide","","- Fe Ho2 Mo O7 -","- Fe Ho2 Mo O7 -","- Fe6 Ho12 Mo6 O42 -","6","0.333333","","Veith, Gabriel M.; Lobanov, Maxim V.; Emge, Thomas J.; Greenblatt, Martha; Croft, Mark; Stowasser, Frank; Hadermann, Joke; Tendeloo, Gustaaf Van","Synthesis and characterization of the new Ln2FeMoO7 (Ln = Y, Dy, Ho) compounds","Journal of Materials Chemistry","2004","14","10","1623","","10.1039/b315028c","powder diffraction","","","CuKα","","","","","","","","","","1.31","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204789","7.4361","0.0001","7.4361","","16.9464","0.0003","90","","90","","120","","811.519","0.018","","","293","","","","","","","","","4","R -3 :H","-R 3","148","Dysprosium Iron Molybdenum Oxide","Dysprosium Iron Molybdenum Oxide","","- Dy2 Fe Mo O7 -","- Dy2 Fe Mo O7 -","- Dy12 Fe6 Mo6 O42 -","6","0.333333","","Veith, Gabriel M.; Lobanov, Maxim V.; Emge, Thomas J.; Greenblatt, Martha; Croft, Mark; Stowasser, Frank; Hadermann, Joke; Tendeloo, Gustaaf Van","Synthesis and characterization of the new Ln2FeMoO7 (Ln = Y, Dy, Ho) compounds","Journal of Materials Chemistry","2004","14","10","1623","","10.1039/b315028c","powder diffraction","","1.54056","CuK\α~1~","","","","","","","","","","1.18","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204802","9.93931","0.00013","9.93931","","7.28485","0.0001","90","","90","","120","","623.252","0.012","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ge La1.6 O4.45 -","- Ge La1.6 O4.4472 -","- Ge6 La9.6 O26.6832 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","x-ray","0.400269","","","","","","","","","0.04954","","66.75","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204803","9.76655","0.00018","9.76655","","7.20962","0.00014","90","","90","","120","","595.56","0.016","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.59 O4.38 Si -","- La1.59133 O4.37667 Si -","- La9.548 O26.26 Si6 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","neutron","1.88604","","","","","","","","","0.05287","","","","","","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204804","9.72566","0.00004","9.72566","","7.18636","0.00004","90","","90","","120","","588.678","0.004","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.59 O4.36 Si -","- La1.59133 O4.36133 Si -","- La9.548 O26.168 Si6 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","","1.5406","Kα~1~","","","","","","","","0.03241","","91.35","","","","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204805","10.00745","0.00028","10.00745","","7.33341","0.00022","90","","90","","120","","636.04","0.03","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ge La1.6 O4.41 -","- Ge La1.6 O4.409 -","- Ge6 La9.6 O26.454 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","neutron","1.88604","","","","","","","","","0.41286","","2.42","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204806","9.9658","0.00019","9.9658","","7.3116","0.00016","90","","90","","120","","628.879","0.018","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ge La1.6 O4.43 -","- Ge La1.6 O4.42833 -","- Ge6 La9.6 O26.57 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","","","","","","","","","","","","","2.09","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204807","3.62266","","3.62266","","3.62266","","90","","90","","90","","47.543","","","","","","","","","","","","","1","F m -3 m","-F 4 2 3","225","","","","- Fe -","- Fe -","- Fe4 -","4","0.0208333","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204808","9.80882","0.0002","9.80882","","7.23353","0.00016","90","","90","","120","","602.718","0.018","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.59 O4.37 Si -","- La1.59133 O4.37367 Si -","- La9.548 O26.242 Si6 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","neutron","1.88604","","","","","","","","","0.04755","","1.99","","","","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204811","11.248","0.011","13.72","0.03","17.3","0.02","71.56","0.15","83.08","0.11","68.62","0.15","2358","7","200","","200","","","","","","","","","5","P -1","-P 1","2","","[Pb(dimb)(dmf)(NO3)2]","","- C18 H23 N7 O7 Pb -","- C18 H23 N7 O7 Pb -","- C72 H92 N28 O28 Pb4 -","4","2","","Sui, Bin; Zhao, Wei; Ma, Guohong; Okamura, Taka-aki; Fan, Jian; Li, Yi-Zhi; Tang, Sing-Hai; Sun, Wei-Yin; Ueyama, Norikazu","Novel Pb(ii) coordination frameworks: synthesis, crystal structures and unusual third-order nonlinear optical propertiesElectronic supplementary information (ESI) available: crystal packing diagram of complex 2. See http://www.rsc.org/suppdata/jm/b3/b315682f/","Journal of Materials Chemistry","2004","14","10","1631","","10.1039/b315682f","","","0.71075","MoKα","","0.0703","0.0397","","","0.0785","0.084","","","","","","0.866","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204812","11.968","0.002","10.0376","0.0018","16.579","0.003","90","","92.804","0.003","90","","1989.3","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Pb(dimb)(SCN)2]","","- C34 H32 N12 O0 Pb2 S4 -","- C34 H32 N12 Pb2 S4 -","- C68 H64 N24 Pb4 S8 -","2","0.5","","Sui, Bin; Zhao, Wei; Ma, Guohong; Okamura, Taka-aki; Fan, Jian; Li, Yi-Zhi; Tang, Sing-Hai; Sun, Wei-Yin; Ueyama, Norikazu","Novel Pb(ii) coordination frameworks: synthesis, crystal structures and unusual third-order nonlinear optical propertiesElectronic supplementary information (ESI) available: crystal packing diagram of complex 2. See http://www.rsc.org/suppdata/jm/b3/b315682f/","Journal of Materials Chemistry","2004","14","10","1631","","10.1039/b315682f","","","0.71073","MoKα","","0.0865","0.0438","","","0.0836","0.0909","","","","","","0.847","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204813","10.236","0.001","11.672","0.002","15.299","0.002","73.5","0.01","86.58","0.01","81.92","0.01","1734.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H34 N9 O7 Pb -","- C33 H34 N9 O7 Pb -","- C66 H68 N18 O14 Pb2 -","2","1","","Sui, Bin; Zhao, Wei; Ma, Guohong; Okamura, Taka-aki; Fan, Jian; Li, Yi-Zhi; Tang, Sing-Hai; Sun, Wei-Yin; Ueyama, Norikazu","Novel Pb(ii) coordination frameworks: synthesis, crystal structures and unusual third-order nonlinear optical propertiesElectronic supplementary information (ESI) available: crystal packing diagram of complex 2. See http://www.rsc.org/suppdata/jm/b3/b315682f/","Journal of Materials Chemistry","2004","14","10","1631","","10.1039/b315682f","","","0.71073","MoKα","","0.0725","0.0565","","","0.1446","0.1489","","","","","","1.043","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204814","3.42","0.006","3.42","","5.938","0.011","90","","90","","120","","60.15","0.15","293","","293","","","","","","","","","2","P -3 m 1","-P 3 2""","164","1T niobium disulfide","niobium disulfide","","- Nb S2 -","- Nb S2 -","- Nb S2 -","1","0.0833333","","Carmalt, Claire J.; Manning, Troy D.; Parkin, Ivan P.; Peters, Emily S.; Hector, Andrew L.","Formation of a new (1T) trigonal NbS2 polytype via atmospheric pressure chemical vapour depositionElectronic supplementary information (ESI) available: structure refinements of the NbS2 films and crystallographic data in CIF format. See http://www.rsc.org/suppdata/jm/b3/b315782m/","Journal of Materials Chemistry","2004","14","3","290","","10.1039/b315782m","powder diffraction","x-ray","1.2982","synchrotron","","","","","","","","0.36152","","1.38","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204828","5.4266","0.0003","9.1466","0.0008","26.211","0.002","90","","92.904","0.005","90","","1299.31","0.17","183","2","183","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H39 N O4 -","- C29 H39 N O4 -","- C58 H78 N2 O8 -","2","1","","Carsten P. Roll; Alexander G. Martin; Helmar Görls; Guido Leibeling; Daniel Guillon; Bertrand Donnio; Wolfgang Weigand","Rodlike metallomesogens containing nickel(II), palladium(II) and copper(II) based on novel enaminoketonato ligands","J. Mater. Chem.","2004","14","11","1722","1730","10.1039/b316731c","","","0.71073","MoKα","","0.1682","0.0823","","","0.1258","0.1522","","","","","","1.014","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204829","5.1776","0.0004","11.785","0.001","20.724","0.002","91.927","0.007","93.548","0.006","91.903","0.007","1260.61","0.19","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H37 N O4 -","- C28 H37 N O4 -","- C56 H74 N2 O8 -","2","1","","Carsten P. Roll; Alexander G. Martin; Helmar Görls; Guido Leibeling; Daniel Guillon; Bertrand Donnio; Wolfgang Weigand","Rodlike metallomesogens containing nickel(II), palladium(II) and copper(II) based on novel enaminoketonato ligands","J. Mater. Chem.","2004","14","11","1722","1730","10.1039/b316731c","","","0.71073","MoKα","","0.1717","0.0857","","","0.152","0.1576","","","","","","2.706","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204830","7.5241","0.0004","9.2447","0.0009","25.918","0.003","91.226","0.003","90.943","0.006","94.782","0.005","1795.8","0.3","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H98 Cl6 N2 O8 Pd -","- C70 H98 Cl6 N2 O8 Pd -","- C70 H98 Cl6 N2 O8 Pd -","1","0.5","","Carsten P. Roll; Alexander G. Martin; Helmar Görls; Guido Leibeling; Daniel Guillon; Bertrand Donnio; Wolfgang Weigand","Rodlike metallomesogens containing nickel(II), palladium(II) and copper(II) based on novel enaminoketonato ligands","J. Mater. Chem.","2004","14","11","1722","1730","10.1039/b316731c","","","0.71069","MoKα","","0.1434","0.0618","","","0.121","0.1321","","","","","","0.759","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204834","7.58","0.001","8.003","0.002","11.652","0.002","88.6","0.02","74.12","0.02","68.84","0.02","631.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(2,6-dichlorophenyl)benzimidazolyl-N,N'-dioxide","","- C13 H7 Cl2 N2 O2 -","- C13 H7 Cl2 N2 O2 -","- C26 H14 Cl4 N4 O4 -","2","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.1348","0.0503","","","0.0981","0.117","","","","","","0.899","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204835","11.803","0.002","7.833","0.001","23.664","0.002","90","","90","","90","","2187.8","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-(2,6-difluorophenyl)benzimidazolyl-N,N'-dioxide","","- C13 H7 F2 N2 O2 -","- C13 H7 F2 N2 O2 -","- C104 H56 F16 N16 O16 -","8","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.1986","0.0455","","","0.0552","0.071","","","","","","0.819","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204836","6.942","0.001","21.265","0.003","8.886","0.001","90","","121.3","0.02","90","","1120.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2,6-difluorophenyl)benzimidazolyl-N,N'-dioxide","","- C13 H7 F2 N2 O2 -","- C13 H7 F2 N2 O2 -","- C52 H28 F8 N8 O8 -","4","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.1253","0.0493","","","0.1079","0.1418","","","","","","0.977","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204837","10.37","0.002","15.787","0.003","7.79","0.001","90","","109.68","0.03","90","","1200.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(2-chloro,6-fluorophenyl)benzimidazolyl-N,N'-dioxide","","- C13 H7 Cl F N2 O2 -","- C13 H7 Cl F N2 O2 -","- C52 H28 Cl4 F4 N8 O8 -","4","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.1158","0.0898","","","0.2183","0.232","","","","","","1.075","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204838","7.396","0.001","20.665","0.003","8.18","0.001","90","","105.38","0.02","90","","1205.4","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-(2-chloro,6-fluorophenyl)benzimidazolyl-N,N'-dioxide","","- C13 H7 Cl F N2 O2 -","- C13 H7 Cl F N2 O2 -","- C52 H28 Cl4 F4 N8 O8 -","4","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.1885","0.0608","","","0.134","0.1675","","","","","","0.848","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204839","8.47","0.001","12.701","0.002","12.44","0.002","90","","93.79","0.02","90","","1335.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2,3,6-trichlorophenyl)benzimidazolyl-N,N'-dioxide","","- C13 H6 Cl3 N2 O2 -","- C13 H6 Cl3 N2 O2 -","- C52 H24 Cl12 N8 O8 -","4","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.109","0.0401","","","0.0887","0.1055","","","","","","0.825","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204840","22.536","0.005","7.868","0.002","13.76","0.002","90","","100.69","0.02","90","","2397.5","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(2,3,4,5,6-pentafluorophenyl)benzimidazolyl-N,N'-dioxide","","- C13 H4 F5 N2 O2 -","- C13 H4 F5 N2 O2 -","- C104 H32 F40 N16 O16 -","8","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.1275","0.0422","","","0.086","0.1027","","","","","","0.814","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204841","13.722","0.001","7.138","0.002","13.316","0.001","90","","118.23","0.02","90","","1149.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3-cyanophenyl)benzimidazolyl-N,N'-dioxide","","- C14 H8 N3 O2 -","- C14 H8 N3 O2 -","- C56 H32 N12 O8 -","4","1","","Zakrassov, Alexander; Shteiman, Vitaly; Sheynin, Yana; Tumanskii, Boris; Botoshansky, Mark; Kapon, Moshe; Keren, Amit; Kaftory, Menahem; Vos, Thomas E.; Miller, Joel S.","Synthesis, structural, and magnetic characterization of substituted benzoimidazole-l-yl N,N?-dioxides","Journal of Materials Chemistry","2004","14","12","1827","","10.1039/b400299g","","","0.71073","MoKα","","0.1133","0.0453","","","0.102","0.1425","","","","","","0.926","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204842","7.791","0.0016","11.819","0.002","15.064","0.003","96.69","0.03","98.74","0.03","104.21","0.03","1311.8","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H26 Br2 S7 -","- C20 H26 Br2 S7 -","- C40 H52 Br4 S14 -","2","1","","Peter J. Skabara; Rory Berridge; Eric J. L. McInnes; David P. West; Simon J. Coles; Michael B. Hursthouse; Klaus Müllen","The electroactivity of tetrathiafulvalene vs. polythiophene: synthesis and characterisation of a fused thieno‒TTF polymer","J. Mater. Chem.","2004","14","13","1964","1969","10.1039/b400809j","","","0.71073","MoKα","","0.0595","0.043","","","0.1149","0.1308","","","","","","0.86","","","","has coordinates,has disorder","180379","2020-10-21","18:00:00",""
"7204843","14.166","0.0002","17.3175","0.0004","19.5311","0.0003","90","","105.037","0.001","90","","4627.3","0.15","110","2","110","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44 H76 Hf O8 -","- C44 H76 Hf O8 -","- C176 H304 Hf4 O32 -","4","0.5","","Pasko, Sergej V.; Hubert-Pfalzgraf, Liliane G.; Abrutis, Adulfas; Richard, Philippe; Bartasyte, Ausrine; Kazlauskiene, Vida","New sterically hindered Hf, Zr and Y ?-diketonates as MOCVD precursors for oxide films","Journal of Materials Chemistry","2004","14","8","1245","","10.1039/b401052c","","","0.71073","MoKα","","0.034","0.0297","","","0.0725","0.0748","","","","","","1.089","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204854","8.5848","0.0006","9.1884","0.0006","11.9256","0.0008","102.997","0.002","94.614","0.002","115.952","0.002","806.81","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C4 H18 N3 Ni O10 P3 Zn2 -","- C4 H14 N3 Ni O10 P3 Zn2 -","- C8 H28 N6 Ni2 O20 P6 Zn4 -","2","1","","Lin, Zhi-En; Zhang, Jie; Zheng, Shou-Tian; Yang, Guo-Yu","Synthesis and characterization of a novel open-framework nickel?zinc phosphite with intersecting three-dimensional 16-ring channels","Journal of Materials Chemistry","2004","14","10","1652","","10.1039/b402321h","","","0.71073","MoKα","","","0.0381","","","0.1028","0.106","","","","","","1.15","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204857","14.059","0.003","14.27","0.003","27.053","0.005","88.27","0.03","86.65","0.03","86.02","0.03","5403.2","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C121 H74 Cl2 Mo12 O40 P -","- C121 H74 Cl2 Mo12 O40 P -","- C242 H148 Cl4 Mo24 O80 P2 -","2","1","","Eugenio Coronado; José R. Galán-Mascarós; Carlos Giménez-Saiz; Carlos J. Gómez-García; Eugenia Martínez-Ferrero; Manuel Almeida; Elsa B. Lopes; Silvia C. Capelli; Rosa M. Llusar","New conducting radical salts based upon Keggin-type polyoxometalates and perylene","J. Mater. Chem.","2004","14","12","1867","1872","10.1039/b402630f","","","0.7","synchrotron","","0.0928","0.0733","","","0.1822","0.2164","","","","","","1.088","","","","has coordinates,has disorder","180379","2020-10-21","18:00:00",""
"7204858","13.9695","0.0002","14.1207","0.0002","27.557","0.0003","87.3761","0.0005","89.5155","0.0005","86.1853","0.0005","5418.06","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C122 H75 Mo12 N O40 P -","- C122 H75 Mo12 N O40 P -","- C244 H150 Mo24 N2 O80 P2 -","2","1","","Eugenio Coronado; José R. Galán-Mascarós; Carlos Giménez-Saiz; Carlos J. Gómez-García; Eugenia Martínez-Ferrero; Manuel Almeida; Elsa B. Lopes; Silvia C. Capelli; Rosa M. Llusar","New conducting radical salts based upon Keggin-type polyoxometalates and perylene","J. Mater. Chem.","2004","14","12","1867","1872","10.1039/b402630f","","","0.71073","MoKα","","0.064","0.0406","","","0.1185","0.141","","","","","","1.18","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204859","18.366","0.004","18.547","0.005","19.172","0.005","83.033","0.007","84.736","0.007","67.564","0.007","5984","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C122 H126 N2 O40 Si W12 -","- C122 H126 N2 O40 Si W12 -","- C244 H252 N4 O80 Si2 W24 -","2","1","","Eugenio Coronado; José R. Galán-Mascarós; Carlos Giménez-Saiz; Carlos J. Gómez-García; Eugenia Martínez-Ferrero; Manuel Almeida; Elsa B. Lopes; Silvia C. Capelli; Rosa M. Llusar","New conducting radical salts based upon Keggin-type polyoxometalates and perylene","J. Mater. Chem.","2004","14","12","1867","1872","10.1039/b402630f","","","0.71069","MoKα","","0.4312","0.1451","","","0.3111","0.415","","","","","","0.924","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204862","17.0947","0.0011","17.0947","0.0011","10.7531","0.0008","90","","90","","90","","3142.4","0.4","297","2","297","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C6 H26 Co3 N6 O28 P4 W4 -","- C6 H26 Co3 N6 O28 P4 W4 -","- C24 H104 Co12 N24 O112 P16 W16 -","4","0.25","","Yan, Bangbo; Goh, Ngoh K.; Chia, Lian S.; Stucky, Galen D.","Hydrothermal synthesis, structures and catalytic properties of the new open-framework cobalt tungsten phosphates (enH2)3[Co3W4P4O28] and K6[Co3W4P4O28]�4H2O","Journal of Materials Chemistry","2004","14","10","1567","","10.1039/b402942a","","","0.71073","MoKα","","0.0623","0.0399","","","0.0838","0.0911","","","","","","1.05","","","","has coordinates,has disorder","180379","2020-10-21","18:00:00",""
"7204863","16.96","0.005","16.96","0.005","10.705","0.005","90","","90","","90","","3079.2","1.9","299","2","299","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Co3 H8 K6 O32 P4 W4 -","- Co3 K6 O31.8 P4 W4 -","- Co12 K24 O127.2 P16 W16 -","4","0.25","","Yan, Bangbo; Goh, Ngoh K.; Chia, Lian S.; Stucky, Galen D.","Hydrothermal synthesis, structures and catalytic properties of the new open-framework cobalt tungsten phosphates (enH2)3[Co3W4P4O28] and K6[Co3W4P4O28]�4H2O","Journal of Materials Chemistry","2004","14","10","1567","","10.1039/b402942a","","","0.71073","MoKα","","0.1066","0.0547","","","0.0955","0.1106","","","","","","0.997","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204870","6.054","0.003","8.226","0.004","19.641","0.009","87.74","0.04","81.23","0.04","82.53","0.04","958.3","0.8","296.2","","","","","","","","","","","4","P -1","-P 1","2","2,5-Bis-(2,2')bithiophenyl-5-yl-thiazolo(5,4-d)thiazole","","","- C20 H10 N2 S6 -","- C20 H7 N2 S6 -","- C40 H14 N4 S12 -","2","1","","Ando, Shinji; Nishida, Jun-ichi; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, physical properties, and field-effect transistors of novel thiophene/thiazolothiazole co-oligomers","Journal of Materials Chemistry","2004","14","12","1787","","10.1039/b403699a","","","0.7107","MoKα","","","0.0648","","","","0.163","","","","","","2.136","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204889","15.1447","0.0008","21.8075","0.0012","15.6767","0.0008","90","","107.16","0.006","90","","4947","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(TPA)4[Cu8(i-mnt)6],2MeCN","tetrakis-tetrapropylamonium-hexa-iso-maleonitrile- octa-cuprate(I)bis-acetonitrile solvate","","- C76 H118 Cu8 N18 S12 -","- C76 H118 Cu8 N18 S12 -","- C152 H236 Cu16 N36 S24 -","2","0.5","","Perruchas, Sandrine; Boubekeur, Kamal; Auban-Senzier, Pascale","Radical cation salts of TTF derivatives incorporating the maleonitriledithiolate copper cluster anion [Cu8(i-mnt)6]4?","Journal of Materials Chemistry","2004","14","24","3509","","10.1039/b411014e","","","0.71073","MoKα","","0.1239","0.0315","","","0.0588","0.0926","","","","","","1.032","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204890","12.8019","0.0011","16.5389","0.0014","17.5845","0.0017","95.819","0.011","91.382","0.011","109.792","0.01","3478.4","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(BEDT-TTF)6[Cu8(i-mnt)6](CH2Cl2)4","hexakis-bisethylenedithiotetrathiafulvalenium-hexa-iso-maleonitrile- octa-cuprate(I)-tetrakis-dichloromethane solvate","","- C44 H28 Cl4 Cu4 N6 S30 -","- C44 H28 Cl4 Cu4 N6 S30 -","- C88 H56 Cl8 Cu8 N12 S60 -","2","1","","Perruchas, Sandrine; Boubekeur, Kamal; Auban-Senzier, Pascale","Radical cation salts of TTF derivatives incorporating the maleonitriledithiolate copper cluster anion [Cu8(i-mnt)6]4?","Journal of Materials Chemistry","2004","14","24","3509","","10.1039/b411014e","","","0.71073","MoKα","","0.092","0.0828","","","0.1957","0.2049","","","","","","1.027","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204891","11.8708","0.0014","14.59","0.002","16.714","0.002","76.93","0.016","77.497","0.014","72.449","0.015","2654","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTF)6[Cu8(i-mnt)6]","hexakis-ethylenedithiotetrathiafulvalenium-hexa-iso-maleonitrile- octa-cuprate(I)","","- C72 H36 Cu8 N12 S48 -","- C72 H24 Cu8 N12 S48 -","- C72 H24 Cu8 N12 S48 -","1","0.5","","Perruchas, Sandrine; Boubekeur, Kamal; Auban-Senzier, Pascale","Radical cation salts of TTF derivatives incorporating the maleonitriledithiolate copper cluster anion [Cu8(i-mnt)6]4?","Journal of Materials Chemistry","2004","14","24","3509","","10.1039/b411014e","","","0.71073","MoKα","","0.1509","0.0713","","","0.1703","0.2154","","","","","","1.05","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204904","2.886","","2.886","","2.886","","90","","90","","90","","24.037","","","","","","","","","","","","","1","I m -3 m","-I 4 2 3","229","","","","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204906","20.9371","0.0005","21.3218","0.0004","8.1858","0.0002","90","","104.179","0.001","90","","3542.95","0.14","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 O7 Y -","- C21 H14 O7 Y -","- C168 H112 O56 Y8 -","8","1","","Thirumurugan, A.; Pati, Swapan K.; Green, Mark A.; Natarajan, Srinivasan","Observation of tancoite-like chains in a one-dimensional metal?organic polymer","Journal of Materials Chemistry","2003","13","12","2937","","10.1039/b310778g","","","0.71073","MoKα","","0.0709","0.0378","","","0.0702","0.0816","","","","","","1.024","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204917","5.3361","0.0006","8.765","0.0008","14.952","0.001","90","","98.871","0.008","90","","690.95","0.11","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Phenazine fumaric acid","dibenzopyrazine trans-2-butenedioc acid","","- C16 H12 N2 O4 -","- C16 H12 N2 O4 -","- C32 H24 N4 O8 -","2","0.5","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.0468","0.034","","","0.0918","0.1011","","","","","","1.043","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204918","26.833","0.026","7.095","0.004","19.613","0.027","90","","127.46","0.07","90","","2964","6","295","2","295","2","","","","","","","Aldrich","4","C 1 2/c 1","-C 2yc","15","Phenazine mesaconic acid","dibenzopyrazine trans-2-methyl-2-butenedioic acid","","- C17 H14 N2 O4 -","- C17 H14 N2 O4 -","- C136 H112 N16 O32 -","8","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.0799","0.0407","","0.1183","0.101","","","","1.014","1.085","1.085","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204919","5.513","0.002","6.733","0.002","13.026","0.007","95.32","0.03","99.39","0.04","100.24","0.03","465.7","0.3","295","2","295","2","","","","","","","Sigma-Aldrich Company Ltd.","4","P -1","-P 1","2","Phenazine bis(maleic acid)","dibenzopyrazine bis(cis-2-butenedioic acid)","","- C20 H16 N2 O8 -","- C20 H16 N2 O8 -","- C20 H16 N2 O8 -","1","0.5","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.046","0.0339","","0.0986","0.0887","","","","1.005","1.002","1.002","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204920","6.679","0.0009","18.66","0.002","8.933","0.001","90","","105.13","0.02","90","","1074.7","0.2","295","2","295","2","","","","","","","Sigma-Aldrich Company Ltd.","4","P 1 21/n 1","-P 2yn","14","Phenazine bis (citraconic acid)","dibenzopyrazine bis(cis-2-methyl-2-butenedioic acid)","","- C11 H10 N O4 -","- C11 H10 N O4 -","- C44 H40 N4 O16 -","4","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.1091","0.0393","","0.1262","0.0867","","","","0.926","0.963","0.963","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204921","5.2792","0.0004","9.057","0.001","15.054","0.001","90","","99.141","0.007","90","","710.65","0.11","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Phenazine succinic acid","dibenzopyrazine butanedioic acid","","- C8 H7 N O2 -","- C8 H7 N O2 -","- C32 H28 N4 O8 -","4","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.0456","0.0347","","","0.1011","0.1366","","","","","","1.211","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204922","5.6755","0.0005","9.997","0.002","10.866","0.001","116.611","0.01","95.117","0.011","90.044","0.01","548.44","0.14","295","2","295","2","","","","","","","","4","P -1","-P 1","2","Phenazine bis(glutaric acid)","dibenzopyrazine bis(pentanedioic acid)","","- C11 H12 N O4 -","- C11 H12 N O4 -","- C22 H24 N2 O8 -","2","1","","Batchelor, Elaine; Klinowski, Jacek; Jones, William","Crystal engineering using co‐crystallisation of phenazine with dicarboxylic acids","Journal of Materials Chemistry","2000","10","4","839","","10.1039/a908214j","","","0.71069","MoKα","","0.1099","0.0463","","","0.1078","0.1319","","","","","","0.984","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204923","27.99","0.003","7.946","0.002","13.357","0.001","90","","103.415","0.009","90","","2889.7","0.8","297","","297","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 As F6 N4 O S18 -","- C52 H36 As0.5 F6 N4 O S18 -","- C104 H72 As F12 N8 O2 S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.062","","","0.073","","","","","1.728","1.728","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204924","27.67","0.01","7.601","0.001","13.342","0.003","90","","102.05","0.03","90","","2744.3","1.3","90","","90","","","","","","","","","7","P 1 a 1","P -2ya","7","","","","- C52 H36 B F4 N4 O S18 -","- C52 H36 B F4 N4 O S18 -","- C104 H72 B2 F8 N8 O2 S36 -","2","1","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0805","","","0.0847","","","","","2.249","2.249","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204925","27.78","0.01","7.826","0.001","13.346","0.003","90","","101.99","0.02","90","","2838.2","1.3","300","","300","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 B F4 N4 O S18 -","- C52 H36 B0.5 F4 N4 O S18 -","- C104 H72 B F8 N8 O2 S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.105","","","7654360","","","","","194189","194189","","","","","has coordinates","195719","2020-10-21","18:00:00",""
"7204926","27.866","0.001","7.926","0.001","13.3035","0.0006","90","","103.59","0.004","90","","2856","0.4","297","","297","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H34 F6 N4 O P S18 -","- C52 H36 F6 N4 O P0.5 S18 -","- C104 H72 F12 N8 O2 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0773","","","0.1034","","","","","2.455","2.455","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204927","27.879","0.005","7.954","0.006","13.337","0.002","90","","103.61","0.01","90","","2874","2","296","","296","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C51 H34 F6 N4 O2 P S18 -","- C50 H36 F6 N4 O P0.5 S18 -","- C100 H72 F12 N8 O2 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0952","","","0.1175","","","","","2.344","2.344","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204928","27.665","0.002","7.781","0.002","13.3065","0.0007","90","","103.709","0.005","90","","2782.8","0.8","100","","100","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 F6 N4 O P S18 -","- C52 H36 F6 N4 O2 P0.5 S18 -","- C104 H72 F12 N8 O4 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0752","","","0.0929","","","","","2.812","2.812","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204929","27.972","0.003","7.934","0.002","13.366","0.001","90","","102.931","0.008","90","","2891.1","0.8","297","","297","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H34 F6 N4 O P S18 -","- C52 H36 F6 N4 O P0.5 S18 -","- C104 H72 F12 N8 O2 P S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0783","","","0.1031","","","","","2.132","2.132","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204930","27.712","0.002","7.787","0.002","13.3297","0.0009","90","","103.888","0.006","90","","2792.4","0.8","75","","75","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C52 H36 As F6 N4 O S18 -","- C52 H36 As0.5 F6 N4 O S18 -","- C104 H72 As F12 N8 O2 S36 -","2","0.5","","Uruichi, Mikio; Yakushi, Kyuya; Yamashita, Yoshiro","Optical properties and metal‒insulator transitions in organic metals (BEDT-ATD)2X(solvent) (X = PF6, AsF6, BF4; solvent = THF, DHF, DO) [BEDT-ATD = 4,11-bis(4',5'-ethylenedithio-1',3'-dithiol-2'-ylidene)-4,11-dihydroanthra[2,3-c][1,2,5]thiadiazole]","Journal of Materials Chemistry","2000","10","12","2716","","10.1039/b002904l","","","0.7107","MoKα","","","0.0702","","","0.0925","","","","","2.283","2.283","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204931","13.036","0.003","8.7286","0.0017","12.938","0.003","90","","90","","90","","1472.2","0.6","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","sodium zinc germanate hydroxide hydrate","","","- Ge2 H4 Na2 O8 Zn -","- Ge4 H8 Na4 O16 Zn2 -","- Ge16 H32 Na16 O64 Zn8 -","4","0.5","","Reisner, Barbara A.; Tripathi, Akhilesh; Parise, John B.","Na8[Zn4Ge8O18(OH)12]·2H2O: An interrupted-framework zincogermanate built from [GeO3(OH)] and [Ge2(OH)2] units","Journal of Materials Chemistry","2001","11","3","887","","10.1039/b004668j","","","0.71073","MoKα","","0.0595","0.0434","","","0.1206","0.1293","","","","","","1.06","","","","has coordinates","288259","2023-12-12","16:04:06",""
"7204932","46.295","0.005","5.334","0.001","20.156","0.002","90","","94.11","0.01","90","","4964.5","1.2","170","2","170","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H16 F52 S4 Sn -","- C32 H16 F52 S4 Sn -","- C128 H64 F208 S16 Sn4 -","4","0.5","","Hibbert, Tom G.; Mahon, Mary F.; Molloy, Kieran C.; Price, Louise S.; Parkin, Ivan P.","Deposition of tin sulfide thin films from novel, volatile (fluoroalkythiolato)tin(iv) precursors","Journal of Materials Chemistry","2001","11","2","469","","10.1039/b005863g","","","0.71069","MoKα","","0.0479","0.0319","","","0.0839","0.0897","","","","","","0.869","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204933","17.192","0.001","8.553","0.002","8.342","0.001","90","","90","","90","","1226.6","0.3","293","2","293","2","","","","","","","","4","P b a 2","P 2 -2ab","32","","","","- C24 H20 S4 Sn -","- C24 H20 S4 Sn -","- C48 H40 S8 Sn2 -","2","0.5","","Barone, Giampaolo; Hibbert, Tom G.; Mahon, Mary F.; Molloy, Kieran C.; Price, Louise S.; Parkin, Ivan P.; Hardy, Amanda M. E.; Field, Mark N.","Deposition of tin sulfide thin films from tin(iv) thiolate precursors","Journal of Materials Chemistry","2001","11","2","464","","10.1039/b005888m","","","0.7093","","","0.0872","0.0527","","0.1494","0.1179","","","","1.073","1.244","1.244","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204934","5.481","0.004","6.791","0.008","35.877","0.029","90","","90","","90","","1335","2","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H15 N3 O2 -","- C14 H15 N3 O2 -","- C56 H60 N12 O8 -","4","1","","Langley, Philip J.; Bailey, Ray T.; Cruickshank, Frank R.; Kennedy, Alan R.; Lochran, Stephen; Pugh, David; Sherwood, John N.; Viikki, Anna; Wallis, John D.","Synthesis, characterisation and structure‒property analysis of derivatives of the non-linear optical material 5-nitro-N-(1-phenylethyl)pyridin-2-amine","Journal of Materials Chemistry","2001","11","4","1047","","10.1039/b008124h","","","0.71069","MoKα","","0.0765","0.0573","","0.1794","0.1718","","","","1.234","1.318","1.318","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204935","11.415","0.0007","10.6973","0.0005","16.935","0.002","90","","102.638","0.009","90","","2017.8","0.3","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H15 N3 O2 -","- C14 H15 N3 O2 -","- C84 H90 N18 O12 -","6","3","","Langley, Philip J.; Bailey, Ray T.; Cruickshank, Frank R.; Kennedy, Alan R.; Lochran, Stephen; Pugh, David; Sherwood, John N.; Viikki, Anna; Wallis, John D.","Synthesis, characterisation and structure‒property analysis of derivatives of the non-linear optical material 5-nitro-N-(1-phenylethyl)pyridin-2-amine","Journal of Materials Chemistry","2001","11","4","1047","","10.1039/b008124h","","","0.71069","MoKα","","0.0635","0.0501","","0.1288","0.1186","","","","0.661","0.713","0.713","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204936","8.979","0.001","15.977","0.002","9.41","0.002","90","","96.52","0.01","90","","1341.2","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H15 N3 O2 -","- C14 H15 N3 O2 -","- C56 H60 N12 O8 -","4","2","","Langley, Philip J.; Bailey, Ray T.; Cruickshank, Frank R.; Kennedy, Alan R.; Lochran, Stephen; Pugh, David; Sherwood, John N.; Viikki, Anna; Wallis, John D.","Synthesis, characterisation and structure‒property analysis of derivatives of the non-linear optical material 5-nitro-N-(1-phenylethyl)pyridin-2-amine","Journal of Materials Chemistry","2001","11","4","1047","","10.1039/b008124h","","","0.71069","MoKα","","0.0643","0.0481","","0.1351","0.1101","","","","0.942","1.029","1.029","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204937","6.9781","0.0011","22.337","0.004","8.3899","0.0012","90","","91.149","0.012","90","","1307.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N3 O2 -","- C14 H15 N3 O2 -","- C56 H60 N12 O8 -","4","1","","Langley, Philip J.; Bailey, Ray T.; Cruickshank, Frank R.; Kennedy, Alan R.; Lochran, Stephen; Pugh, David; Sherwood, John N.; Viikki, Anna; Wallis, John D.","Synthesis, characterisation and structure‒property analysis of derivatives of the non-linear optical material 5-nitro-N-(1-phenylethyl)pyridin-2-amine","Journal of Materials Chemistry","2001","11","4","1047","","10.1039/b008124h","","","0.71069","MoKα","","0.0663","0.0398","","","0.1006","0.1188","","","","","","1.055","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7204938","10.348","0.0006","15.55","0.001","9.261","0.0005","98.125","0.005","107.703","0.004","75.622","0.003","1371.67","0.14","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H26 Cl F2 I2 S24 -","- C40 H26 Cl0.5 F2 I2 S24 -","- C40 H26 Cl0.5 F2 I2 S24 -","1","0.5","","Yamamoto, Hiroshi M.; Maeda, Ryoko; Yamaura, Jun-Ichi; Kato, Reizo","Structural and physical properties of conducting cation radical salts containing supramolecular assemblies based on p-bis(iodoethynyl)benzene derivatives","Journal of Materials Chemistry","2001","11","4","1034","","10.1039/b008170l","","","0.7107","MoKα","","","0.0327","","","0.0408","","","","","2.762","2.762","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204939","10.353","0.001","15.387","0.002","9.394","0.001","98.466","0.007","107.504","0.008","76.364","0.008","1382.2","0.3","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H26 Br F2 I2 S24 -","- C40 H26 Br0.5 F2 I2 S24 -","- C40 H26 Br0.5 F2 I2 S24 -","1","0.5","","Yamamoto, Hiroshi M.; Maeda, Ryoko; Yamaura, Jun-Ichi; Kato, Reizo","Structural and physical properties of conducting cation radical salts containing supramolecular assemblies based on p-bis(iodoethynyl)benzene derivatives","Journal of Materials Chemistry","2001","11","4","1034","","10.1039/b008170l","","","0.7107","MoKα","","0.1649","0.1413","","0.3765","","","","","0.931","","","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204940","10.198","0.001","15.559","0.002","9.296","0.001","99.634","0.006","106.931","0.007","76.581","0.007","1364.6","0.3","293.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H28 Cl I2 S24 -","- C40 H28 Cl I2 S24 -","- C40 H28 Cl I2 S24 -","1","0.5","","Yamamoto, Hiroshi M.; Maeda, Ryoko; Yamaura, Jun-Ichi; Kato, Reizo","Structural and physical properties of conducting cation radical salts containing supramolecular assemblies based on p-bis(iodoethynyl)benzene derivatives","Journal of Materials Chemistry","2001","11","4","1034","","10.1039/b008170l","","","0.7107","MoKα","","","0.0702","","","","0.0753","","","","","","3.83","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204941","10.193","0.002","15.034","0.003","9.423","0.002","95.75","0.02","106.92","0.02","86.66","0.02","1373.9","0.5","293.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H28 Br I2 S24 -","- C40 H28 Br I2 S24 -","- C40 H28 Br I2 S24 -","1","0.5","","Yamamoto, Hiroshi M.; Maeda, Ryoko; Yamaura, Jun-Ichi; Kato, Reizo","Structural and physical properties of conducting cation radical salts containing supramolecular assemblies based on p-bis(iodoethynyl)benzene derivatives","Journal of Materials Chemistry","2001","11","4","1034","","10.1039/b008170l","","","0.7107","MoKα","","","0.0797","","","","0.1008","","","","","","2.335","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204942","13.18","0.001","19.128","0.002","12.464","0.0006","105.25","0.004","112.817","0.005","82.455","0.004","2792.9","0.4","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H24 Br F4 I2 S24 -","- C40 H24 Br F4 I2 S24 -","- C80 H48 Br2 F8 I4 S48 -","2","1","","Yamamoto, Hiroshi M.; Maeda, Ryoko; Yamaura, Jun-Ichi; Kato, Reizo","Structural and physical properties of conducting cation radical salts containing supramolecular assemblies based on p-bis(iodoethynyl)benzene derivatives","Journal of Materials Chemistry","2001","11","4","1034","","10.1039/b008170l","","","0.7107","MoKα","","","0.0383","","","0.0421","","","","","2.157","2.157","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7204943","23.072","0.002","14.695","0.001","6.277","0.0003","90","","96.928","0.005","90","","2112.6","0.3","293.2","","293.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 Cl2 I2 S16 -","- C32 H24 Cl2 I2 S16 -","- C64 H48 Cl4 I4 S32 -","2","0.5","","Yamamoto, Hiroshi M.; Maeda, Ryoko; Yamaura, Jun-Ichi; Kato, Reizo","Structural and physical properties of conducting cation radical salts containing supramolecular assemblies based on p-bis(iodoethynyl)benzene derivatives","Journal of Materials Chemistry","2001","11","4","1034","","10.1039/b008170l","","","0.7107","MoKα","","","0.0463","","","0.0518","","","","","3.537","3.537","","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7204945","10.2793","0.0008","11.5639","0.0009","7.4822","0.0006","90","","90","","90","","889.4","0.12","293","2","293","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C4 H4 Co N2 O6 V2 -","- C4 H4 Co N2 O6 V2 -","- C16 H16 Co4 N8 O24 V8 -","4","0.5","","Zheng, Li-Min; Wang, Xiqu; Wang, Yongsheng; Jacobson, Allan J.","Syntheses and characterization of Co2(4,4'-bipy)2(V4O12), Co(pz)(VO3)2 and Co2(2-pzc)(H2O)(VO3)3 (4,4'-bipy = 4,4'-bipyridine, pz = pyrazine, 2-pzc = 2-pyrazinecarboxylate)","Journal of Materials Chemistry","2001","11","4","1100","","10.1039/b009091n","","","0.71073","MoKα","","0.036","0.0273","","0.0626","0.0596","","","","1.058","1.085","1.085","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204946","8.164","0.002","8.587","0.002","10.162","0.002","87.04","0.03","75.72","0.03","75.02","0.03","666.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H8 Co N2 O6 V2 -","- C10 H8 Co N2 O6 V2 -","- C20 H16 Co2 N4 O12 V4 -","2","1","","Zheng, Li-Min; Wang, Xiqu; Wang, Yongsheng; Jacobson, Allan J.","Syntheses and characterization of Co2(4,4'-bipy)2(V4O12), Co(pz)(VO3)2 and Co2(2-pzc)(H2O)(VO3)3 (4,4'-bipy = 4,4'-bipyridine, pz = pyrazine, 2-pzc = 2-pyrazinecarboxylate)","Journal of Materials Chemistry","2001","11","4","1100","","10.1039/b009091n","","","0.71073","MoKα","","0.0401","0.0327","","0.0822","0.0784","","","","1.029","1.049","1.049","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204947","15.253","0.0012","8.2554","0.0007","10.6784","0.0009","90","","90","","90","","1344.62","0.19","295","2","295","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C5 H5 Co2 N2 O12 V3 -","- C5 H5 Co2 N2 O12 V3 -","- C20 H20 Co8 N8 O48 V12 -","4","1","","Zheng, Li-Min; Wang, Xiqu; Wang, Yongsheng; Jacobson, Allan J.","Syntheses and characterization of Co2(4,4'-bipy)2(V4O12), Co(pz)(VO3)2 and Co2(2-pzc)(H2O)(VO3)3 (4,4'-bipy = 4,4'-bipyridine, pz = pyrazine, 2-pzc = 2-pyrazinecarboxylate)","Journal of Materials Chemistry","2001","11","4","1100","","10.1039/b009091n","","","0.71073","MoKα","","0.0322","0.0265","","0.0597","0.0581","","","","1.04","1.07","1.07","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204948","10.0083","0.0009","10.14","0.001","10.569","0.002","90","","93.89","0.01","90","","1070.1","0.2","293","","293","","","","","","","","Hydrothermal synthezis","5","P 1 21/a 1","-P 2yab","14","","Lead Vanadium(V) Monophosphate Hydrate","","- H4 O14 P2 Pb2 V2 -","- O14 P2 Pb2 V2 -","- O56 P8 Pb8 V8 -","4","1","","Leclaire, Andre; Chardon, Josiane; Raveau, Bernard","Hydrothermal synthesis and crystal structure of a lead vanadium monophosphate hydrate with an open structure: Pb2V2O4(PO4)2·2H2O","Journal of Materials Chemistry","2001","11","5","1482","","10.1039/b009367j","","","0.71073","xray_tube","","","0.0285","","","","0.0239","","","","","","1.341","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7204953","8.5441","0.0002","8.9831","0.0002","9.0836","0.0002","90","","91.2411","0.0015","90","","697.03","0.03","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H4 Na4 O36 P8 V4 Zn4 -","- Na4 O36 P8 V4 Zn4 -","- Na4 O36 P8 V4 Zn4 -","1","0.25","","Le Fur, E.; Moreno, Y.; Pivan, J. Y.","On the new oxovanadium phosphate NaZnVOPO4(HPO4) obtained at 510 K from hydrothermal treatment","Journal of Materials Chemistry","2001","11","6","1735","","10.1039/b009952j","","","0.71073","MoKalpha","","0.0286","0.0259","","0.0692","0.068","","","","1.228","1.253","1.253","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204954","9.2994","0.0004","9.751","0.0004","14.3348","0.0006","90","","90.974","0.001","90","","1299.67","0.09","130","2","130","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C6 H27 N4 O21 P5 Zn5 -","- C6 H27 N4 O21 P5 Zn5 -","- C12 H54 N8 O42 P10 Zn10 -","2","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0306","0.028","","0.0646","0.0636","","","","1.051","1.068","1.068","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204955","5.1971","0.0006","7.6972","0.0009","17.336","0.002","90","","90.618","0.002","90","","693.45","0.14","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H5 N2 O4 P Zn -","- C3 H5 N2 O4 P Zn -","- C12 H20 N8 O16 P4 Zn4 -","4","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0524","0.0434","","0.1326","0.1179","","","","1.334","1.256","1.256","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204956","8.6145","0.0009","9.6187","0.001","17.038","0.002","90","","93.571","0.002","90","","1409","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H15 N2 O12 P3 Zn2 -","- C4 H20 N2.66667 O16 P4 Zn2.66667 -","- C12 H60 N8 O48 P12 Zn8 -","3","0.75","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0833","0.0448","","0.1368","0.1013","","","","1.068","0.961","0.961","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204957","17.2792","0.0007","5.1929","0.0002","20.1154","0.0006","90","","92.569","0.002","90","","1803.12","0.11","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C H N O P Zn -","- C0.75 H3.5 N0.5 O4 P Zn -","- C12 H56 N8 O64 P16 Zn16 -","16","2","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0447","0.0369","","0.1187","0.0928","","","","1.112","0.947","0.947","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204958","5.2176","0.0002","8.7802","0.0004","16.0811","0.0007","89.34","0.002","83.537","0.001","74.337","0.001","704.7","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H12 N2 O12 P3 Zn3 -","- C3 H12 N2 O12 P3 Zn3 -","- C6 H24 N4 O24 P6 Zn6 -","2","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0481","0.0423","","0.1222","0.1061","","","","1.062","0.995","0.995","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204959","13.6086","0.0004","13.6086","0.0004","15.2777","0.0008","90","","90","","120","","2450.28","0.16","571","2","571","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C2 H0 N0.83 O4 P Zn1.17 -","- C2 N0.833333 O4 P Zn1.16667 -","- C36 N15 O72 P18 Zn21 -","18","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0512","0.0433","","0.1622","0.1549","","","","1.449","1.44","1.44","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204960","8.0636","0.0009","8.4566","0.001","9.0234","0.0011","111.941","0.002","107.957","0.002","103.649","0.002","498.09","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H11 N2 O8 P2 Zn2 -","- C3 H11 N2 O8 P2 Zn2 -","- C6 H22 N4 O16 P4 Zn4 -","2","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0542","0.0437","","0.1152","0.1094","","","","1.059","1.104","1.104","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204961","14.772","0.002","8.8271","0.0014","10.107","0.002","90","","131.983","0.002","90","","979.6","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C H5 N O4 P Zn -","- C H5 N O4 P Zn -","- C8 H40 N8 O32 P8 Zn8 -","8","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0595","0.0433","","0.1022","0.0961","","","","1.037","1.121","1.121","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204962","5.1351","0.0007","10.7598","0.0015","10.7714","0.0015","66.541","0.002","89.025","0.002","81.698","0.002","539.7","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H12 N2 O8 P2 Zn2 -","- C4 H12 N2 O8 P2 Zn2 -","- C8 H24 N4 O16 P4 Zn4 -","2","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0479","0.0311","","0.0757","0.0697","","","","0.962","1.028","1.028","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204963","5.222","0.0012","12.756","0.004","15.674","0.006","90","","90","","90","","1044.1","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C H N O P Zn -","- C1.2 H5.6 N0.8 O3.2 P0.8 Zn0.4 -","- C12 H56 N8 O32 P8 Zn4 -","10","2.5","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0268","0.0221","","0.0572","0.0553","","","","1.102","1.085","1.085","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204964","5.2677","0.0005","13.3025","0.0013","14.7833","0.0014","90","","96.049","0.001","90","","1030.15","0.17","298","2","571","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H13 N2 O8 P2 Zn -","- C3 H13 N2 O8 P2 Zn -","- C12 H52 N8 O32 P8 Zn4 -","4","1","","Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R.","Transformations of the low-dimensional zinc phosphates to complex open-framework structures. Part 2: one-dimensional ladder to two- and three-dimensional structures","Journal of Materials Chemistry","2001","11","5","1537","","10.1039/b010001n","","","0.71073","MoKα","","0.0366","0.029","","0.0916","0.0783","","","","1.127","1.033","1.033","","","","","has coordinates","180380","2020-10-21","18:00:00",""
"7204965","18.724","0.004","12.034","0.004","17.318","0.005","90","","96.8","0.02","90","","3874.7","1.9","296.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H24 N O2 -","- C24 H24 N O2 -","- C192 H192 N8 O16 -","8","1","","Oka, Hiroyuki; Tamura, Tomoki; Miura, Yozo; Teki, Yoshio","Synthesis and characterization of poly(1,3-phenylene)-based polyradicals carrying cyclic aminoxyls","Journal of Materials Chemistry","2001","11","5","1364","","10.1039/b100060h","","","0.7107","MoKα","","","0.0414","","","","0.0368","","","","","","1.641","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7204966","16.708","0.002","16.708","0.002","16.708","0.002","90","","90","","90","","4664.2","1","293","2","293","2","","","","","","","","4","I -4 3 m","I -4 2 3","217","","","","- As2 H18 O35 V10 -","- As3 O52.5 V15 -","- As12 O210 V60 -","4","0.0833333","","Zhao, Yongnan; Liu, Qingsheng; Li, Yafeng; Chen, Xiangming; Mai, Zhenhong","Hydrothermal synthesis, structure and catalytic property of a novel open-framework oxovanadium arsenate","Journal of Materials Chemistry","2001","11","6","1553","1554","10.1039/b102336p","","","0.71073","MoKα","","0.1099","0.0569","","0.1392","0.0775","","","","1.133","1.199","1.199","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204967","9.9182","0.0005","29.591","0.002","10.1562","0.0005","90","","109.443","0.002","90","","2810.8","0.3","296.2","","296.2","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C32 H27 Cl7 Mn S24 -","- C31 H30.5 Cl5.5 Mn0.5 S24 -","- C62 H61 Cl11 Mn S48 -","2","0.5","","Naito, Toshio; Inabe, Tamotsu; Takeda, Keiji; Awaga, Kunio; Akutagawa, Tomoyuki; Hasegawa, Tatsuo; Nakamura, Takayoshi; Kakiuchi, Toru; Sawa, Hiroshi; Yamamoto, Takashi; Tajima, Hiroyuki","β″-(ET)3(MnCl4)(1,1,2-C2H3Cl3) (ET = bis(ethylenedithio)tetrathiafulvalene); a pressure-sensitive new molecular conductor with localized spins","Journal of Materials Chemistry","2001","11","9","2221","","10.1039/b102786g","","","0.7107","MoKα","","0.0781","0.0781","","0.0891","","0.0891","","","4.39","","","4.39","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204968","10.983","0.005","12.8986","0.0019","13.627","0.007","83.21","0.02","81.05","0.04","82.2","0.02","1880","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H30 Mo3 O9.5 -","- C50 H30 Mo3 O9.5 -","- C100 H60 Mo6 O19 -","2","1","","Clemente-León, Miguel; Coronado, Eugenio; Giménez-Saiz, Carlos; Gómez-García, Carlos J.; Martínez-Ferrero, Eugenia; Almeida, Manuel; Lopes, Elsa B.","Organic/inorganic molecular conductors based upon perylene and Lindquist-type polyoxometalates","Journal of Materials Chemistry","2001","11","9","2176","","10.1039/b103032a","","","0.71069","MoKα","","0.114","0.035","","","0.0779","0.0935","","","","","","0.984","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204969","10.9272","0.0009","12.7077","0.0011","13.5723","0.0012","82.1386","0.0019","83.3466","0.0018","81.4233","0.0018","1837.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H30 O9.5 V0.5 W2.5 -","- C50 H30 O9.5 V0.51 W2.49 -","- C100 H60 O19 V1.02 W4.98 -","2","1","","Clemente-León, Miguel; Coronado, Eugenio; Giménez-Saiz, Carlos; Gómez-García, Carlos J.; Martínez-Ferrero, Eugenia; Almeida, Manuel; Lopes, Elsa B.","Organic/inorganic molecular conductors based upon perylene and Lindquist-type polyoxometalates","Journal of Materials Chemistry","2001","11","9","2176","","10.1039/b103032a","","","0.71069","MoKα","","0.1128","0.0562","","","0.1272","0.1432","","","","","","0.906","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204989","11.068","0.002","14.472","0.002","17.82","0.003","90","","90","","90","","2854.3","0.8","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C38 H32 N2 -","- C38 H31 N2 -","- C152 H124 N8 -","4","1","","Kennedy, Alan R.; Smith, W. Ewen; Tackley, Daniel R.; David, William I. F.; Shankland, Kenneth; Brown, Bev; Teat, Simon J.","Tetraaryl biphenyl diamine hole transport materials: a structural study utilizing both single crystal and high resolution powder diffraction","Journal of Materials Chemistry","2002","12","2","168","","10.1039/b107278c","","","0.6892","synchrotron","","0.0868","0.0668","","","0.1485","0.1561","","","","","","1.065","","","","has coordinates,has disorder","180380","2020-10-21","18:00:00",""
"7205001","4.6598","0.0007","5.6862","0.0009","4.9159","0.0007","90","","90.521","0.003","90","","130.25","0.03","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","CoMoO4-II","","","- Co Mo O4 -","- Co Mo O4 -","- Co2 Mo2 O8 -","2","0.5","","Livage, Carine; Hynaux, Amélie; Marrot, Jérôme; Nogues, Marc; Férey, Gérard","Solution process for the synthesis of the “high-pressure” phase CoMoO4 and X-ray single crystal resolution","Journal of Materials Chemistry","2002","12","5","1423","","10.1039/b110760g","","","0.71073","MoKα","","0.0329","0.027","","0.0687","0.066","","","","1.05","1.086","1.086","","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205020","5.318","0.001","15.358","0.002","10.804","0.002","90","","95.65","0.02","90","","878.1","0.3","297","","297","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Imidazolium acetophosphonate","","","- C5 H9 N2 O5 P -","- C5 H9 N2 O5 P -","- C20 H36 N8 O20 P4 -","4","1","","Videnova-Adrabińska, Veneta","Ring templated nanochannel architecture of imidazolium phosphonoacetate","Journal of Materials Chemistry","2002","12","10","2931","2935","10.1039/b202064p","","","0.71073","MoKα","","","0.05","","","","0.065","","","","","","1.88","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205031","16.124","0.0017","16.124","0.0017","7.6023","0.0011","90","","90","","120","","1711.7","0.4","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","copper hydroxymethylphosphonate","copper hydroxymethylphosphonate","","- C H3 Cu O4 P -","- C H2 Cu O4 P -","- C18 H36 Cu18 O72 P18 -","18","1","","Hix, Gary B.; Turner, Adele; Kariuki, Benson M.; Tremayne, Maryjane; MacLean, Elizabeth J.","Strategies for the synthesis of porous metal phosphonate materialsBasis of a presentation given at Materials Discussion No. 5, 22???25 September 2002, Madrid, Spain.","Journal of Materials Chemistry","2002","12","11","3220","","10.1039/b204131f","","","0.71073","MoKα","","0.0336","0.0309","","","0.0814","0.0826","","","","","","0.619","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205032","9.556","0.0013","12.611","0.002","5.2318","0.0008","90","","90","","90","","630.49","0.16","296","2","296","2","","","","","","","","6","P n a 21","P 2c -2n","33","zinc amidomethylphosphonate","","","- C2 H6 N O5 P Zn -","- C2 H4 N O5 P Zn -","- C8 H16 N4 O20 P4 Zn4 -","4","1","","Hix, Gary B.; Turner, Adele; Kariuki, Benson M.; Tremayne, Maryjane; MacLean, Elizabeth J.","Strategies for the synthesis of porous metal phosphonate materialsBasis of a presentation given at Materials Discussion No. 5, 22???25 September 2002, Madrid, Spain.","Journal of Materials Chemistry","2002","12","11","3220","","10.1039/b204131f","","","0.71069","MoKα","","0.0313","0.0311","","","0.0831","0.0833","","","","","","1.085","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205033","4.925","0.0003","22.0972","0.0003","12.9038","0.0003","90","","99.245","0.002","90","","1386.06","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","trizinc dicarboxymethylphosphonate hydrate","trizinc dicarboxymethylphosphonate hydrate","","- C4 H6.76 O11.38 P2 Zn3 -","- C4 H4 O11.382 P2 Zn3 -","- C16 H16 O45.528 P8 Zn12 -","4","1","","Hix, Gary B.; Turner, Adele; Kariuki, Benson M.; Tremayne, Maryjane; MacLean, Elizabeth J.","Strategies for the synthesis of porous metal phosphonate materialsBasis of a presentation given at Materials Discussion No. 5, 22???25 September 2002, Madrid, Spain.","Journal of Materials Chemistry","2002","12","11","3220","","10.1039/b204131f","","","0.71073","MoKα","","0.0778","0.0649","","","0.1589","0.1654","","","","","","1.051","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205035","8.8667","0.0014","7.1872","0.0011","10.8038","0.0017","90","","91.653","0.003","90","","688.2","0.19","143","2","143","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Neodymium sulfate amonium","","","- H4 N Nd O8 S2 -","- H4 N Nd O8 S2 -","- H16 N4 Nd4 O32 S8 -","4","1","","Ruiz-Valero, Caridad; Cascales, Concepción; Gómez-Lor, Berta; Gutiérrez-Puebla, Enrique; Iglesias, Marta; Monge, M. Angeles; Snejko, Natalia","New catalytically active neodymium sulfate","Journal of Materials Chemistry","2002","12","10","3073","3077","10.1039/b205215f","","","0.71073","MoKα","","0.0865","0.0658","","","0.1536","0.1618","","","","","","0.965","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205036","8.8605","0.0008","7.1183","0.0007","10.669","0.001","90","","91.324","0.002","90","","672.73","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Europium Sulfate Ammonium","","","- Eu H4 N O8 S2 -","- Eu H4 N O8 S2 -","- Eu4 H16 N4 O32 S8 -","4","1","","Ruiz-Valero, Caridad; Cascales, Concepción; Gómez-Lor, Berta; Gutiérrez-Puebla, Enrique; Iglesias, Marta; Monge, M. Angeles; Snejko, Natalia","New catalytically active neodymium sulfate","Journal of Materials Chemistry","2002","12","10","3073","3077","10.1039/b205215f","","","0.71073","MoKα","","0.0531","0.0376","","","0.0823","0.0881","","","","","","1.067","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7205044","20.9868","0.0006","21.5521","0.0007","8.3162","0.0003","90","","103.95","0.001","90","","3650.6","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 Nd O7 -","- C21 H14 Nd O7 -","- C168 H112 Nd8 O56 -","8","1","","Thirumurugan, A.; Pati, Swapan K.; Green, Mark A.; Natarajan, Srinivasan","Observation of tancoite-like chains in a one-dimensional metal?organic polymer","Journal of Materials Chemistry","2003","13","12","2937","","10.1039/b310778g","","","0.71073","MoKα","","0.0284","0.0216","","","0.0524","0.0546","","","","","","0.969","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205045","20.9794","0.0007","21.3829","0.0007","8.2116","0.0003","90","","104.089","0.001","90","","3572.9","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 Dy O7 -","- C21 H14 Dy O7 -","- C168 H112 Dy8 O56 -","8","1","","Thirumurugan, A.; Pati, Swapan K.; Green, Mark A.; Natarajan, Srinivasan","Observation of tancoite-like chains in a one-dimensional metal?organic polymer","Journal of Materials Chemistry","2003","13","12","2937","","10.1039/b310778g","","","0.71073","MoKα","","0.0315","0.0242","","","0.0601","0.0631","","","","","","1.049","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205046","20.9674","0.0003","14.5059","0.0002","10.9862","0.0001","90","","117.825","0.002","90","","2955.12","0.08","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N,N'-diphenyl-N,N'-bis(4,4'-methylphenyl)-[(1,1'-biphenyl)]-4,4'-diamine","","- C38 H32 N2 -","- C38 H32 N2 -","- C152 H128 N8 -","4","1","","Kennedy, Alan R.; Smith, W. Ewen; Tackley, Daniel R.; David, William I. F.; Shankland, Kenneth; Brown, Bev; Teat, Simon J.","Tetraaryl biphenyl diamine hole transport materials: a structural study utilizing both single crystal and high resolution powder diffraction","Journal of Materials Chemistry","2002","12","2","168","","10.1039/b107278c","powder diffraction","","0.80008","","","","","","","","","","","3.26","","","","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205543","9.9543","0.0007","5.9678","0.0004","10.1404","0.0007","90","","90","","90","","602.39","0.07","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","selenolo(3,2-b)thiophene","selenolo[3,2-b]thiophene","","- C6 H4 S Se -","- C6 H4 S Se -","- C24 H16 S4 Se4 -","4","0.5","","Mishra, Sarada P.; Javier, Anna E.; Zhang, Rui; Liu, Junying; Belot, John A.; Osaka, Itaru; McCullough, Richard D.","Mixed selenium-sulfur fused ring systems as building blocks for novel polymers used in field effect transistors","Journal of Materials Chemistry","2011","21","5","1551","","10.1039/c0jm00602e","","","0.71073","MoKα","","0.0224","0.0201","","","0.0585","0.0596","","","","","","1.058","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205544","18.4493","0.0018","16.6052","0.0016","14.1055","0.0012","90","","99.196","0.004","90","","4265.7","0.7","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H42 O S9 -","- C43 H42 O S9 -","- C172 H168 O4 S36 -","4","1","","Wright, Iain A.; Skabara, Peter J.; Forgie, John C.; Kanibolotsky, Alexander L.; González, Blanca; Coles, Simon J.; Gambino, Salvatore; Samuel, Ifor D. W.","Electronic, redox and charge transport properties of an unusual hybrid structure: a bis(septithiophene) bridged by a fused tetrathiafulvalene (TTF)","Journal of Materials Chemistry","2011","21","5","1462","","10.1039/c0jm02293d","","","0.71073","MoKα","","0.2375","0.1478","","","0.2442","0.2903","","","","","","1.114","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205545","11.7929","0.0002","12.7339","0.0003","15.5721","0.0004","82.895","0.001","74.031","0.002","66.263","0.002","2057.8","0.09","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","","","- C87 H84 S20 -","- C87 H84 S20 -","- C87 H84 S20 -","1","0.5","","Wright, Iain A.; Skabara, Peter J.; Forgie, John C.; Kanibolotsky, Alexander L.; González, Blanca; Coles, Simon J.; Gambino, Salvatore; Samuel, Ifor D. W.","Electronic, redox and charge transport properties of an unusual hybrid structure: a bis(septithiophene) bridged by a fused tetrathiafulvalene (TTF)","Journal of Materials Chemistry","2011","21","5","1462","","10.1039/c0jm02293d","","","0.71073","MoKα","","0.0702","0.0532","","","0.1385","0.15","","","","","","1.021","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205546","6.2605","0.0007","29.481","0.004","8.9958","0.001","90","","92.235","0.003","90","","1659.1","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 O6 -","- C18 H22 O6 -","- C72 H88 O24 -","4","1","","Murphy, Erin B.","The return of photoelastic stress measurements: utilizing birefringence to monitor damage and repair in healable materials","Journal of Materials Chemistry","2011","21","5","1438","","10.1039/c0jm02308f","","","0.71073","MoKα","","0.0929","0.0527","","","0.1255","0.1503","","","","","","0.936","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205547","12.357","0.002","12.711","0.002","14.644","0.003","91.192","0.003","104.382","0.003","101.723","0.003","2175.4","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C50.83 H41.74 N2.91 O12 Si -","- C50.82 H41.73 N2.91 O12 Si -","- C101.64 H83.46 N5.82 O24 Si2 -","2","1","","Sarkar, Arindam; Tham, Fook S.; Haddon, Robert C.","Synthesis, crystallization, electrochemistry and single crystal X-ray analysis of a methoxy-substituted-tris-phenalenyl based neutral radical","Journal of Materials Chemistry","2011","21","5","1574","","10.1039/c0jm02397c","","","0.71073","MoKα","","0.1138","0.0547","","","0.1258","0.1563","","","","","","1.043","","","","has coordinates,has disorder","180386","2020-10-21","18:00:00",""
"7205548","13.1909","0.0002","41.2909","0.0005","11.657","0.0002","90","","105.166","0.0004","90","","6128.02","0.16","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70.72 H56.44 B Cl3.44 O12 Si -","- C70.72 H56.44 B Cl3.44 O12 Si -","- C282.88 H225.76 B4 Cl13.76 O48 Si4 -","4","1","","Sarkar, Arindam; Tham, Fook S.; Haddon, Robert C.","Synthesis, crystallization, electrochemistry and single crystal X-ray analysis of a methoxy-substituted-tris-phenalenyl based neutral radical","Journal of Materials Chemistry","2011","21","5","1574","","10.1039/c0jm02397c","","","0.71073","MoKα","","0.08","0.0557","","","0.1408","0.1562","","","","","","1.041","","","","has coordinates,has disorder","180386","2020-10-21","18:00:00",""
"7205549","12.097","0.008","13.934","0.009","16.889","0.01","90","","94.519","0.012","90","","2838","3","297","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H22 F6 N2 -","- C36 H22 F6 N2 -","- C144 H88 F24 N8 -","4","1","","Li, Yueqin; Xu, Huihua; Tao, Xian; Qian, Kejia; Fu, Shuang; Shen, Yingzhong; Ding, Shijin","Synthesis and memory characteristics of highly organo-soluble polyimides bearing a noncoplanar twisted biphenyl unit containing aromatic side-chain groups","Journal of Materials Chemistry","2011","21","6","1810","","10.1039/c0jm02547j","","","0.71073","MoKα","","0.1284","0.0695","","","0.1494","0.1791","","","","","","1.044","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205550","17.257","0.004","17.152","0.003","15.542","0.003","90","","116.36","0.03","90","","4122","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H36 F6 O8 -","- C48 H36 F6 O8 -","- C192 H144 F24 O32 -","4","1","","Li, Yueqin; Xu, Huihua; Tao, Xian; Qian, Kejia; Fu, Shuang; Shen, Yingzhong; Ding, Shijin","Synthesis and memory characteristics of highly organo-soluble polyimides bearing a noncoplanar twisted biphenyl unit containing aromatic side-chain groups","Journal of Materials Chemistry","2011","21","6","1810","","10.1039/c0jm02547j","","","0.71073","MoKα","","0.1483","0.0969","","","0.2126","0.2426","","","","","","1.185","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205551","10.9511","0.0003","10.1813","0.0003","14.9822","0.0004","90","","96.815","0.001","90","","1658.66","0.08","103","2","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H19 Cl2 N6 O Pt -","- C12 H19 Cl2 N6 O Pt -","- C48 H76 Cl8 N24 O4 Pt4 -","4","1","","McKinnon, Stephen D. J.; Gilroy, Joe B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G.","Magnetostructural studies of palladium(ii) and platinum(ii) complexes of verdazyl radicals","Journal of Materials Chemistry","2011","21","5","1523","","10.1039/c0jm02560g","","","0.71073","MoKα","","0.0218","0.0187","","","0.0446","0.0457","","","","","","1.082","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205552","6.9439","0.0008","11.4246","0.0013","15.6571","0.0018","90","","90","","90","","1242.1","0.2","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H10 Cl2 N5 O Pd -","- C9 H10 Cl2 N5 O Pd -","- C36 H40 Cl8 N20 O4 Pd4 -","4","1","","McKinnon, Stephen D. J.; Gilroy, Joe B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G.","Magnetostructural studies of palladium(ii) and platinum(ii) complexes of verdazyl radicals","Journal of Materials Chemistry","2011","21","5","1523","","10.1039/c0jm02560g","","","0.71073","MoKα","","0.0165","0.0159","","","0.0399","0.0402","","","","","","1.09","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205553","9.9445","0.0009","17.0345","0.0016","10.1105","0.001","90","","105.865","0.0012","90","","1647.5","0.3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 Cl2 N5 O Pd -","- C13 H18 Cl2 N5 O Pd -","- C52 H72 Cl8 N20 O4 Pd4 -","4","1","","McKinnon, Stephen D. J.; Gilroy, Joe B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G.","Magnetostructural studies of palladium(ii) and platinum(ii) complexes of verdazyl radicals","Journal of Materials Chemistry","2011","21","5","1523","","10.1039/c0jm02560g","","","0.71073","MoKα","","0.0355","0.0261","","","0.0626","0.0664","","","","","","1.041","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205554","9.8844","0.0013","17.179","0.002","10.068","0.0014","90","","106.072","0.002","90","","1642.8","0.4","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 Cl2 N5 O Pt -","- C13 H18 Cl2 N5 O Pt -","- C52 H72 Cl8 N20 O4 Pt4 -","4","1","","McKinnon, Stephen D. J.; Gilroy, Joe B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G.","Magnetostructural studies of palladium(ii) and platinum(ii) complexes of verdazyl radicals","Journal of Materials Chemistry","2011","21","5","1523","","10.1039/c0jm02560g","","","0.71073","MoKα","","0.0444","0.0291","","","0.0608","0.0666","","","","","","1.051","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205555","11.0168","0.0006","10.3045","0.0006","14.9488","0.0009","90","","96.9769","0.0008","90","","1684.46","0.17","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H19 Cl2 N6 O Pd -","- C12 H19 Cl2 N6 O Pd -","- C48 H76 Cl8 N24 O4 Pd4 -","4","1","","McKinnon, Stephen D. J.; Gilroy, Joe B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G.","Magnetostructural studies of palladium(ii) and platinum(ii) complexes of verdazyl radicals","Journal of Materials Chemistry","2011","21","5","1523","","10.1039/c0jm02560g","","","0.71073","MoKα","","0.0211","0.0195","","","0.0498","0.0509","","","","","","1.07","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205556","13.18","0.008","21.194","0.013","7.735","0.005","90","","95.299","0.007","90","","2151","2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H56 N2 S6 -","- C44 H56 N2 S6 -","- C88 H112 N4 S12 -","2","0.5","","McEntee, Greg J.; Vilela, Filipe; Skabara, Peter J.; Anthopoulos, Thomas D.; Labram, John G.; Tierney, Steve; Harrington, Ross W.; Clegg, William","Self-assembly and charge transport properties of a benzobisthiazole end-capped with dihexyl thienothiophene units","Journal of Materials Chemistry","2011","21","7","2091","","10.1039/c0jm02607g","","","0.6889","synchrotron","","0.0723","0.0499","","","0.1219","0.1338","","","","","","1.032","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205557","11.2179","0.0007","14.6724","0.001","17.2101","0.0012","90","","94.816","0.002","90","","2822.7","0.3","150","","150","2","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H24 N4 O4 Zr -","- C36 H24 N4 O4 Zr -","- C144 H96 N16 O16 Zr4 -","4","1","","Kathirgamanathan, Poopathy; Surendrakumar, Sivagnanasundram; Antipan-Lara, Juan; Ravichandran, Seenivasagam; Reddy, Vanga R.; Ganeshamurugan, Subramaniam; Kumaraverl, Muttulingam; Arkley, Vincent; Blake, Alexander J.; Bailey, Daniel","Discovery of two new phases of zirconium tetrakis(8-hydroxyquinolinolate): synthesis, crystal structure and their electron transporting characteristics in organic light emitting diodes (OLEDs)","Journal of Materials Chemistry","2011","21","6","1762","","10.1039/c0jm02644a","","","0.71073","MoKα","","0.0603","0.0368","","","0.0788","0.0864","","","","","","0.95","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205558","20.112","0.0007","8.292","0.0003","17.3925","0.0006","90","","90","","90","","2900.52","0.18","300","","300","","","","","","","","see text","5","P c a 21","P 2c -2ac","29","","","","- C36 H24 N4 O4 Zr -","- C36 H24 N4 O4 Zr -","- C144 H96 N16 O16 Zr4 -","4","1","","Kathirgamanathan, Poopathy; Surendrakumar, Sivagnanasundram; Antipan-Lara, Juan; Ravichandran, Seenivasagam; Reddy, Vanga R.; Ganeshamurugan, Subramaniam; Kumaraverl, Muttulingam; Arkley, Vincent; Blake, Alexander J.; Bailey, Daniel","Discovery of two new phases of zirconium tetrakis(8-hydroxyquinolinolate): synthesis, crystal structure and their electron transporting characteristics in organic light emitting diodes (OLEDs)","Journal of Materials Chemistry","2011","21","6","1762","","10.1039/c0jm02644a","","x-ray","0.71073","MoKα","","0.0307","0.0253","","","0.0596","0.0616","","","","","","0.99","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205559","7.8299","0.0006","11.0435","0.0003","12.3544","0.0009","90","","90","","90","","1068.28","0.12","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 Ru -","- C13 H16 Ru -","- C52 H64 Ru4 -","4","1","","Jipa, Ilona; Danova, Katya; Popovska, Nadejda; Siddiqi, M. Aslam; Siddiqui, Rehan A.; Atakan, Burak; Cremer, Till; Maier, Florian; Marbach, Hubertus; Steinrück, Hans-Peter; Heinemann, Frank W.; Zenneck, Ulrich","Methylated [(arene)(1,3-cyclohexadiene)Ru(0)] complexes as low-melting MOCVD precursor complexes with a controlled follow-up chemistry of the ligands","Journal of Materials Chemistry","2011","21","9","3014","","10.1039/c0jm02652b","","","0.71073","MoKα","","0.0299","0.0278","","","0.0672","0.068","","","","","","1.205","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7205560","7.6694","0.0004","8.274","0.0004","8.5494","0.0002","91.821","0.003","108.474","0.004","93.874","0.003","512.57","0.04","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C13 H16 Ru -","- C13 H16 Ru -","- C26 H32 Ru2 -","2","1","","Jipa, Ilona; Danova, Katya; Popovska, Nadejda; Siddiqi, M. Aslam; Siddiqui, Rehan A.; Atakan, Burak; Cremer, Till; Maier, Florian; Marbach, Hubertus; Steinrück, Hans-Peter; Heinemann, Frank W.; Zenneck, Ulrich","Methylated [(arene)(1,3-cyclohexadiene)Ru(0)] complexes as low-melting MOCVD precursor complexes with a controlled follow-up chemistry of the ligands","Journal of Materials Chemistry","2011","21","9","3014","","10.1039/c0jm02652b","","","0.71073","MoKα","","0.0293","0.0231","","","0.05","0.0514","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7205561","5.9529","0.0001","7.9576","0.0005","19.791","0.001","90","","90","","90","","937.52","0.08","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H14 Ru -","- C12 H14 Ru -","- C48 H56 Ru4 -","4","1","","Jipa, Ilona; Danova, Katya; Popovska, Nadejda; Siddiqi, M. Aslam; Siddiqui, Rehan A.; Atakan, Burak; Cremer, Till; Maier, Florian; Marbach, Hubertus; Steinrück, Hans-Peter; Heinemann, Frank W.; Zenneck, Ulrich","Methylated [(arene)(1,3-cyclohexadiene)Ru(0)] complexes as low-melting MOCVD precursor complexes with a controlled follow-up chemistry of the ligands","Journal of Materials Chemistry","2011","21","9","3014","","10.1039/c0jm02652b","","","0.71073","MoKα","","0.0118","0.0114","","","0.0265","0.0266","","","","","","1.093","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7205562","9.4415","0.0003","8.0573","0.0003","8.1969","0.0003","90","","90.41","0.002","90","","623.55","0.04","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 O2 S4 -","- C12 H10 O2 S4 -","- C24 H20 O4 S8 -","2","0.5","","Wijsboom, Yair Haim; Sheynin, Yana; Patra, Asit; Zamoshchik, Natalia; Vardimon, Ran; Leitus, Gregory; Bendikov, Michael","Tuning of electronic properties and rigidity in PEDOT analogs","Journal of Materials Chemistry","2011","21","5","1368","","10.1039/c0jm02679d","","","0.71073","MoKα","","0.0636","0.0628","","","0.13","0.1304","","","","","","1.373","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7205563","8.1576","0.0004","13.1699","0.0013","15.4841","0.0009","78.71","0.007","80.782","0.005","88.271","0.006","1610.3","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H11 I4 O4 S12 -","- C20 H11 I4 O4 S12 -","- C40 H22 I8 O8 S24 -","2","1","","Lakhdar, Youssef; Mézière, Cécile; Zorina, Leokadiya; Giffard, Michel; Batail, Patrick; Canadell, Enric; Auban-Senzier, Pascale; Pasquier, Claude; Jérome, Denis; Náfrádi, Bálint; Fórró, László","Dual [proton]/[hole] mixed valence in a molecular metal: balancing chemical activity in the solid state by tapping into a molecular hole reservoir","Journal of Materials Chemistry","2011","21","5","1516","","10.1039/c0jm02897e","","","0.71073","MoKα","","0.0563","0.027","","","0.0489","0.0557","","","","","","1.008","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205564","5.0316","0.001","6.4982","0.0013","10.301","0.002","90","","91.56","0.03","90","","336.68","0.12","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C2 H2 N4 -","- C2 H2 N4 -","- C8 H8 N16 -","4","1","","Qi, Cai; Li, Sheng-Hua; Li, Yu-Chuan; Wang, Yuan; Chen, Xu-Kun; Pang, Si-Ping","A novel stable high-nitrogen energetic material: 4,4′-azobis(1,2,4-triazole)","Journal of Materials Chemistry","2011","21","9","3221","","10.1039/c0jm02970j","","","0.71073","MoKα","","0.06","0.0513","","","0.1512","0.1572","","","","","","1.14","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205565","7.2256","0.0002","11.6583","0.0004","12.7817","0.0004","90","","90","","90","","1076.71","0.06","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- B5 Cs2 Li3 O10 -","- B5 Cs2 Li3 O10 -","- B20 Cs8 Li12 O40 -","4","0.5","","Yang, Yun; Pan, Shilie; Hou, Xueling; Wang, Chuanyi; Poeppelmeier, Kenneth R.; Chen, Zhaohui; Wu, Hongping; Zhou, Zhongxiang","A congruently melting and deep UV nonlinear optical material: Li3Cs2B5O10","Journal of Materials Chemistry","2011","21","9","2890","","10.1039/c0jm03187a","","","0.71073","MoKα","","0.0248","0.0246","","","0.0586","0.0587","","","","","","1.036","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205566","10.9816","0.0002","18.0168","0.0003","26.2966","0.0006","90","","106.586","0.001","90","","4986.39","0.17","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H22 Cl N5 O2 -","- C29 H22 Cl N5 O2 -","- C232 H176 Cl8 N40 O16 -","8","2","","Guo, Jixi; Jia, Dianzeng; Liu, Lang; Yuan, Hui; Li, Feng","Solid-state photochromism of pyrazolones with highly improved sensitivity, fatigue resistance and reversible fluorescent switching properties","Journal of Materials Chemistry","2011","21","9","3210","","10.1039/c0jm03216f","","","0.71073","MoKα","","0.0748","0.0486","","","0.1215","0.1548","","","","","","1.112","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205567","12.7246","0.0008","12.41","0.0008","24.2921","0.0015","90","","90","","90","","3836","0.4","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C30 H54 N8 O8 S2 -","- C30 H54 N8 O8 S2 -","- C120 H216 N32 O32 S8 -","4","0.5","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.0389","0.0343","","","0.0941","0.0994","","","","","","1.047","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205568","7.67","0.0006","9.2621","0.0007","29.002","0.002","90","","94.113","0.001","90","","2055","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H56 N8 O8 S2 -","- C32 H56 N8 O8 S2 -","- C64 H112 N16 O16 S4 -","2","0.5","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.0421","0.0374","","","0.1013","0.1056","","","","","","1.063","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205569","7.4293","0.0017","12.136","0.003","16.373","0.004","71.479","0.004","88.241","0.004","87.373","0.004","1398.1","0.6","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C19.5 H33 N8.5 O7.5 S2 -","- C19.5 H33 N8.5 O7.5 S2 -","- C39 H66 N17 O15 S4 -","2","1","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.0509","0.047","","","0.1283","0.1321","","","","","","1.076","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7205570","7.3764","0.0006","12.1391","0.001","16.7417","0.0017","71.392","0.001","85.142","0.002","86.887","0.001","1415","0.2","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 N13 O14 S4 -","- C38 H48 N13 O14 S4 -","- C38 H48 N13 O14 S4 -","1","0.5","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.1394","0.1209","","","0.3826","0.402","","","","","","1.783","","","","has coordinates,has disorder","180386","2020-10-21","18:00:00",""
"7205571","13.1747","0.001","27.939","0.002","12.1826","0.001","90","","90","","90","","4484.3","0.6","200","2","200","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C17 H30 N4 O5 S -","- C17 H30 N4 O5 S -","- C136 H240 N32 O40 S8 -","8","","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.0418","0.0371","","","0.1042","0.1096","","","","","","1.048","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205572","7.372","0.0016","16.324","0.004","24.346","0.005","72.595","0.004","89.618","0.004","85.998","0.004","2788.5","1.1","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H64 N17 O15 S4 -","- C39 H64 N17 O15 S4 -","- C78 H128 N34 O30 S8 -","2","1","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.1498","0.0713","","","0.1732","0.2144","","","","","","1.042","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205573","7.5142","0.0004","24.1429","0.0014","17.5439","0.001","90","","90","","90","","3182.7","0.3","200","2","200","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H42 N7 O10 S2 -","- C24 H42 N7 O10 S2 -","- C96 H168 N28 O40 S8 -","4","1","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.0417","0.0386","","","0.1096","0.1127","","","","","","1.075","","","","has coordinates,has disorder","180386","2020-10-21","18:00:00",""
"7205574","7.2608","0.0003","23.5817","0.0011","18.4741","0.0009","90","","90","","90","","3163.2","0.3","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C23 H38 N9 O9 S2 -","- C23 H38 N9 O9 S2 -","- C92 H152 N36 O36 S8 -","4","1","","Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D.","Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks","Journal of Materials Chemistry","2011","21","7","2204","","10.1039/c0jm03449e","","","0.71073","MoKα","","0.0464","0.0382","","","0.092","0.0964","","","","","","1.052","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205575","13.245","0.003","16.006","0.003","29.949","0.006","90","","93.84","0.03","90","","6335","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C39 H35 Ir N4 -","- C39 H35 Ir N4 -","- C312 H280 Ir8 N32 -","8","1","","Peng, Tai; Yang, Yu; Bi, Hai; Liu, Yu; Hou, Zhaomin; Wang, Yue","Highly efficient white organic electroluminescence device based on a phosphorescent orange material doped in a blue host emitter","Journal of Materials Chemistry","2011","21","11","3551","","10.1039/c0jm03645e","","","0.71073","MoKα","","0.0492","0.0373","","","0.0627","0.0661","","","","","","1.022","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205576","8.3907","0.0004","30.6491","0.0014","7.7677","0.0004","90","","105.268","0.001","90","","1927.09","0.16","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H16 N2 O S -","- C25 H16 N2 O S -","- C100 H64 N8 O4 S4 -","4","1","","Yao, Dandan; Zhao, Shanshan; Guo, Jianhua; Zhang, Zuolun; Zhang, Hongyu; Liu, Yu; Wang, Yue","Hydroxyphenyl-benzothiazole based full color organic emitting materials generated by facile molecular modification","Journal of Materials Chemistry","2011","21","11","3568","","10.1039/c1jm00009h","","","0.71073","MoKα","","0.083","0.0466","","","0.1225","0.1461","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205577","6.9711","0.0014","11.626","0.002","16.44","0.003","90","","90.97","0.03","90","","1332.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 N2 O S -","- C15 H14 N2 O S -","- C60 H56 N8 O4 S4 -","4","1","","Yao, Dandan; Zhao, Shanshan; Guo, Jianhua; Zhang, Zuolun; Zhang, Hongyu; Liu, Yu; Wang, Yue","Hydroxyphenyl-benzothiazole based full color organic emitting materials generated by facile molecular modification","Journal of Materials Chemistry","2011","21","11","3568","","10.1039/c1jm00009h","","","0.71073","MoKα","","0.0864","0.0601","","","0.1732","0.1886","","","","","","1.103","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205578","8.832","0.0006","9.9071","0.0007","11.6033","0.0008","84.83","0.001","84.418","0.001","79.062","0.001","989.44","0.12","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H18 N2 O S -","- C25 H18 N2 O S -","- C50 H36 N4 O2 S2 -","2","1","","Yao, Dandan; Zhao, Shanshan; Guo, Jianhua; Zhang, Zuolun; Zhang, Hongyu; Liu, Yu; Wang, Yue","Hydroxyphenyl-benzothiazole based full color organic emitting materials generated by facile molecular modification","Journal of Materials Chemistry","2011","21","11","3568","","10.1039/c1jm00009h","","","0.71073","MoKα","","0.1083","0.0496","","","0.1039","0.1258","","","","","","0.966","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205579","9.949","0.002","15.759","0.003","13.031","0.003","90","","109.1","0.03","90","","1930.6","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 N2 O S -","- C25 H16 N2 O S -","- C100 H64 N8 O4 S4 -","4","1","","Yao, Dandan; Zhao, Shanshan; Guo, Jianhua; Zhang, Zuolun; Zhang, Hongyu; Liu, Yu; Wang, Yue","Hydroxyphenyl-benzothiazole based full color organic emitting materials generated by facile molecular modification","Journal of Materials Chemistry","2011","21","11","3568","","10.1039/c1jm00009h","","","0.71073","MoKα","","0.06","0.0408","","","0.1032","0.1116","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205580","20.542","0.004","7.2295","0.0014","13.494","0.003","90","","98.92","0.03","90","","1979.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H18 N2 O S -","- C25 H18 N2 O S -","- C100 H72 N8 O4 S4 -","4","1","","Yao, Dandan; Zhao, Shanshan; Guo, Jianhua; Zhang, Zuolun; Zhang, Hongyu; Liu, Yu; Wang, Yue","Hydroxyphenyl-benzothiazole based full color organic emitting materials generated by facile molecular modification","Journal of Materials Chemistry","2011","21","11","3568","","10.1039/c1jm00009h","","","0.71073","MoKα","","0.1105","0.0577","","","0.1239","0.1428","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205581","9.7121","0.0014","14.214","0.002","15.29","0.002","90","","104.906","0.002","90","","2039.7","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","tris(2-(4-(trifluoromethyl)-1H-1,2,3-triazol-1-yl)ethyl)amine","","- C15 H15 F9 N10 -","- C15 H15 F9 N10 -","- C60 H60 F36 N40 -","4","1","","Garg, Sonali; Shreeve, Jean'ne M.","Trifluoromethyl- or pentafluorosulfanyl-substituted poly-1,2,3-triazole compounds as dense stable energetic materials","Journal of Materials Chemistry","2011","21","13","4787","","10.1039/c0jm04229c","","","0.71073","MoKα","","0.0614","0.0418","","","0.0913","0.1008","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205582","11.8876","0.0011","11.8876","0.0011","8.2416","0.0009","90","","90","","90","","1164.7","0.2","223","2","223","2","","","","","","","","4","I -4","I -4","82","","? 1,1'-(2,2-bis((4-(trifluoromethyl)-1H-1,2,3-triazol-1-yl)methyl) propane-1,3-diyl)bis(4-(trifluoromethyl)-1H-1,2,3-triazole)?","","- C17 H12 F12 N12 -","- C17 H12 F12 N12 -","- C34 H24 F24 N24 -","2","0.25","","Garg, Sonali; Shreeve, Jean'ne M.","Trifluoromethyl- or pentafluorosulfanyl-substituted poly-1,2,3-triazole compounds as dense stable energetic materials","Journal of Materials Chemistry","2011","21","13","4787","","10.1039/c0jm04229c","","","1.54178","CuKα","","0.0608","0.0607","","","0.1553","0.1554","","","","","","1.046","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205911","24.575","0.003","13.3527","0.0012","20.4212","0.0018","90","","105.367","0.007","90","","6461.5","1.2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C69 H48 F6 Ir N6 P -","- C69 H48 F6 Ir N6 P -","- C276 H192 F24 Ir4 N24 P4 -","4","0.5","","Chen, Hsiao-Fan; Wong, Ken-Tsung; Liu, Yi-Hung; Wang, Yu; Cheng, Yi-Ming; Chung, Min-Wen; Chou, Pi-Tai; Su, Hai-Ching","Bis(diphenylamino)-9,9′-spirobifluorene functionalized Ir(iii) complex: a conceptual design en route to a three-in-one system possessing emitting core and electron and hole transport peripherals","Journal of Materials Chemistry","2011","21","3","768","","10.1039/c0jm02097d","","","0.71073","MoKα","","0.1947","0.1058","","","0.2521","0.3105","","","","","","1.145","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205912","26.259","0.005","14.225","0.003","16.316","0.003","90","","94.423","0.004","90","","6076","2","299","2","299","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C42 H27 N3 -","- C42 H27 N3 -","- C336 H216 N24 -","8","2","","Jiang, Wei; Duan, Lian; Qiao, Juan; Dong, Guifang; Zhang, Deqiang; Wang, Liduo; Qiu, Yong","High-triplet-energy tri-carbazole derivatives as host materials for efficient solution-processed blue phosphorescent devices","Journal of Materials Chemistry","2011","21","13","4918","","10.1039/c0jm03365k","","","0.71073","MoKα","","0.1939","0.094","","","0.1153","0.135","","","","","","1.082","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205913","7.591","0.006","10.23","0.008","8.184","0.006","90","","92.799","0.011","90","","634.8","0.8","298","11","298","11","","","","","","","","4","P 1 21 1","P 2yb","4","Cu(ii)malate enantiomer D","","","- C8 H14 Cu O12 -","- C8 H14 Cu O12 -","- C16 H28 Cu2 O24 -","2","1","","Gudavarthy, Rakesh V.; Burla, Niharika; Kulp, Elizabeth A.; Limmer, Steven J.; Sinn, Ekkehard; Switzer, Jay A.","Epitaxial electrodeposition of chiral CuO films from copper(ii) complexes of malic acid on Cu(111) and Cu(110) single crystals","Journal of Materials Chemistry","2011","21","17","6209","","10.1039/c0jm03423a","","","0.71073","MoKα","","0.0243","0.024","","","0.0659","0.0661","","","","","","1.054","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205914","7.584","0.004","10.214","0.005","8.169","0.004","90","","92.778","0.007","90","","632.1","0.6","298","11","298","11","","","","","","","","4","P 1 21 1","P 2yb","4","Cu(ii)malate enantiomer L","","","- C8 H14 Cu O12 -","- C8 H14 Cu O12 -","- C16 H28 Cu2 O24 -","2","1","","Gudavarthy, Rakesh V.; Burla, Niharika; Kulp, Elizabeth A.; Limmer, Steven J.; Sinn, Ekkehard; Switzer, Jay A.","Epitaxial electrodeposition of chiral CuO films from copper(ii) complexes of malic acid on Cu(111) and Cu(110) single crystals","Journal of Materials Chemistry","2011","21","17","6209","","10.1039/c0jm03423a","","","0.71073","MoKα","","0.0245","0.0241","","","0.0663","0.0666","","","","","","1.024","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205915","8.478","0.006","7.43","0.005","10.295","0.007","90","","102.581","0.009","90","","632.9","0.8","298","11","298","11","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cu(ii)malate racemic DL","","","- C8 H14 Cu O12 -","- C8 H14 Cu O12 -","- C16 H28 Cu2 O24 -","2","0.5","","Gudavarthy, Rakesh V.; Burla, Niharika; Kulp, Elizabeth A.; Limmer, Steven J.; Sinn, Ekkehard; Switzer, Jay A.","Epitaxial electrodeposition of chiral CuO films from copper(ii) complexes of malic acid on Cu(111) and Cu(110) single crystals","Journal of Materials Chemistry","2011","21","17","6209","","10.1039/c0jm03423a","","","0.71073","MoKα","","0.0318","0.0294","","","0.0777","0.0806","","","","","","1.13","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205916","9.84196","0.00004","9.84196","0.00004","10.68317","0.00006","90","","90","","120","","896.177","0.007","298","","","","","","","","","","","5","P 3 1 c","P 3 -2c","159","","","","- Al2 N18.939 O2.061 Si9 Y6.313 -","- Al1.99899 N18.9397 O2.0601 Si9 Y6.31347 -","- Al3.99798 N37.8794 O4.1202 Si18 Y12.6269 -","2","0.333333","","Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun","Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry","Journal of Materials Chemistry","2011","21","15","5780","","10.1039/c0jm03538f","powder diffraction","","1.5493","Synchrotron","","","","","","","","","3.1907","","","","","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205917","10.6431","0.0002","10.6431","0.0002","10.6431","0.0002","90","","90","","90","","1205.6","0.04","298","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- O3 Y2 -","- O2.99994 Y1.99997 -","- O47.999 Y31.9995 -","16","0.333333","","Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun","Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry","Journal of Materials Chemistry","2011","21","15","5780","","10.1039/c0jm03538f","powder diffraction","","1.5493","Synchrotron","","","","","","","","","6.3456","","","","","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205918","7.5492","0.0004","10.4571","0.0005","10.9153","0.0005","90","","110.806","0.005","90","","805.49","0.07","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- N2 O7 Si2 Y4 -","- N2.0002 O6.9998 Si2 Y4 -","- N8.0008 O27.9992 Si8 Y16 -","4","1","","Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun","Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry","Journal of Materials Chemistry","2011","21","15","5780","","10.1039/c0jm03538f","powder diffraction","","1.5493","Synchrotron","","","","","","","","","9.3016","","","","","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205919","6.8239","0.0004","7.2324","0.0003","35.2082","0.0015","90","","90","","90","","1737.64","0.15","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C24 H16 N2 -","- C24 H16 N2 -","- C96 H64 N8 -","4","0.5","","Yoon, Seong-Jun; Park, SooYoung","Polymorphic and mechanochromic luminescence modulation in the highly emissive dicyanodistyrylbenzene crystal: secondary bonding interaction in molecular stacking assembly","Journal of Materials Chemistry","2011","21","23","8338","","10.1039/c0jm03711g","","","0.71073","MoKα","","0.0665","0.0461","","","0.1319","0.1538","","","","","","1.14","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205920","5.96","0.002","7.634","0.003","18.603","0.007","90.145","0.006","95.804","0.006","97.105","0.006","835.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 Ca O10 -","- C16 H14 Ca O10 -","- C32 H28 Ca2 O20 -","2","1","","Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.","Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks","Journal of Materials Chemistry","2011","21","18","6595","","10.1039/c0jm03907a","","","0.71073","MoKα","","0.0885","0.0509","","","0.0915","0.1015","","","","","","0.912","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205921","5.8133","0.0001","7.4885","0.0002","18.6076","0.0006","90.404","0.001","95.523","0.002","95.088","0.002","803.01","0.04","120","","120","2","","","","","","","","4","P -1","-P 1","2","Cadmium anthraquinone-2,3-dicarboxylate","","","- C16 H14 Cd O10 -","- C16 H14 Cd O10 -","- C32 H28 Cd2 O20 -","2","1","","Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.","Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks","Journal of Materials Chemistry","2011","21","18","6595","","10.1039/c0jm03907a","","","0.71073","MoKα","","0.0524","0.0515","","","0.1409","0.1425","","","","","","1.082","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205922","5.8534","0.0017","7.504","0.002","18.599","0.005","91.1","0.02","95.03","0.02","95.97","0.02","809.1","0.4","298.1","","298.1","","","","","","","","","4","P -1","-P 1","2","Cadmium anthraquinone-2,3-dicarboxylate","","","- C16 H14 Cd O10 -","- C16 H14 Cd O10 -","- C32 H28 Cd2 O20 -","2","1","","Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.","Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks","Journal of Materials Chemistry","2011","21","18","6595","","10.1039/c0jm03907a","","","0.7107","MoKα","","0.0775","0.05","","","0.1302","0.1659","","","","","","1.093","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205923","5.799","0.002","7.477","0.003","18.493","0.007","89.639","0.006","85.173","0.006","83.485","0.007","793.8","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Manganese anthraquinone-2,3-dicarboxylate","","","- C16 H14 Mn O10 -","- C16 H14 Mn O10 -","- C32 H28 Mn2 O20 -","2","1","","Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.","Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks","Journal of Materials Chemistry","2011","21","18","6595","","10.1039/c0jm03907a","","","0.71073","MoKα","","0.1359","0.0806","","","0.1826","0.2093","","","","","","1.041","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205924","16.308","0.003","7.4101","0.0015","16.183","0.003","90","","106.064","0.004","90","","1879.3","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ni(II) Anthraquinone-2,3-Dicarboxylic Acid","","","- C16 H20 Ni O13 -","- C16 H20 Ni O13 -","- C64 H80 Ni4 O52 -","4","1","","Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.","Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks","Journal of Materials Chemistry","2011","21","18","6595","","10.1039/c0jm03907a","","","0.71073","MoKα","","0.1131","0.0622","","","0.1284","0.1587","","","","","","1.083","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205925","7.629","0.002","7.843","0.002","15.045","0.005","91.409","0.006","95.784","0.005","115.16","0.005","808.4","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Zinc(II) Anthraquinone-2,3-dicarboxylate","","","- C16 H14 O10 Zn -","- C16 H14 O10 Zn -","- C32 H28 O20 Zn2 -","2","1","","Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.","Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks","Journal of Materials Chemistry","2011","21","18","6595","","10.1039/c0jm03907a","","","0.71073","MoKα","","0.1681","0.0663","","","0.1036","0.1345","","","","","","0.947","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7205926","21.657","0.003","21.657","0.003","57.01","0.02","90","","90","","90","","26739","11","200","2","200","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","Ti16","","","- C64 H142 Cl18 O48 Ti16 -","- C64 H142 Cl18 O48 Ti16 -","- C512 H1136 Cl144 O384 Ti128 -","8","0.25","","Périneau, Fabien; Pensec, Sandrine; Sassoye, Capucine; Ribot, François; van Lokeren, Luk; Willem, Rudolph; Bouteiller, Laurent; Sanchez, Clément; Rozes, Laurence","New hybrid core‒shell star-like architectures made of poly(n-butyl acrylate) grown from well-defined titanium oxo-clusters","Journal of Materials Chemistry","2011","21","12","4470","","10.1039/c0jm04047a","","","0.71073","MoKα","","0.1577","0.0883","","","0.2802","0.3303","","","","","","1.397","","","","has coordinates,has disorder","180390","2020-10-21","18:00:00",""
"7205927","21.887","0.015","11.094","0.007","20.234","0.013","90","","105.373","0.007","90","","4737","5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H39 F12 N4 O0.5 Os P4 -","- C46 H38 F12 N4 O0.5 Os P4 -","- C184 H152 F48 N16 O2 Os4 P16 -","4","1","","Yang, Tianshe; Xia, Ao; Liu, Qian; Shi, Mei; Wu, Huazhou; Xiong, Liqin; Huang, Chunhui; Li, Fuyou","Polymer nanoparticles with an embedded phosphorescent osmium(ii) complex for cell imaging","Journal of Materials Chemistry","2011","21","14","5360","","10.1039/c0jm04235h","","","0.71073","MoKα","","0.0524","0.0381","","","0.0941","0.1007","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7205928","7.17","0.0002","7.17","0.0002","13.662","0.0002","90","","90","","90","","702.35","0.03","120","1","120","1","","","","","","","","4","P 4/m m m","-P 4 2","123","","","","- C22.08 Fe N7.04 Pt -","- C22.08 Fe N7.04 Pt -","- C22.08 Fe N7.04 Pt -","1","0.0625","","Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio","Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature","Journal of Materials Chemistry","2011","21","20","7217","","10.1039/c0jm04387g","","","0.71073","MoKα","","0.0319","0.0311","","","0.0794","0.0798","","","","","","0.859","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7205929","7.231","0.0008","7.231","0.0008","13.812","0.004","90","","90","","90","","722.2","0.2","120","1","120","1","","","","","","","","6","P 4/m m m","-P 4 2","123","","","","- C19 Cl1.56 Fe N6 O0.52 Pt -","- C19 Cl1.56 Fe N6 O0.52 Pt -","- C19 Cl1.56 Fe N6 O0.52 Pt -","1","0.0625","","Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio","Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature","Journal of Materials Chemistry","2011","21","20","7217","","10.1039/c0jm04387g","","","0.71073","MoKα","","0.1092","0.0902","","","0.2335","0.2481","","","","","","1.049","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7205930","7.176","0.0002","7.176","0.0002","13.6663","0.0006","90","","90","","90","","703.75","0.04","100","1","100","1","","","","","","","","5","P 4/m m m","-P 4 2","123","","","","- C23.08 H8 Fe N6 Pt -","- C23.08 H8 Fe N6 Pt -","- C23.08 H8 Fe N6 Pt -","1","0.0625","","Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio","Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature","Journal of Materials Chemistry","2011","21","20","7217","","10.1039/c0jm04387g","","","0.71073","MoKα","","0.0549","0.049","","","0.1401","0.1685","","","","","","1.097","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7205931","9.5346","0.0006","9.5932","0.0006","13.9476","0.0009","96.674","0.005","105.479","0.006","94.841","0.005","1212.24","0.14","173","2","173","2","","","","","","","","2","P -1","-P 1","2","","","","- C36 H24 -","- C36 H24 -","- C72 H48 -","2","1","","Zhao, Zujin; Chen, Shuming; Lam, Jacky W. Y.; Wang, Zhiming; Lu, Ping; Mahtab, Faisal; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Kwok, Hoi Sing; Tang, Ben Zhong","Pyrene-substituted ethenes: aggregation-enhanced excimer emission and highly efficient electroluminescence","Journal of Materials Chemistry","2011","21","20","7210","","10.1039/c0jm04449k","","","1.54178","CuKα","","0.0476","0.0381","","","0.096","0.0994","","","","","","1.012","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205932","8.7695","0.0006","13.3414","0.0011","15.9829","0.0011","77.119","0.008","89.166","0.006","71.187","0.006","1722.2","0.2","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C47 H29 Cl3 -","- C47 H29 Cl3 -","- C94 H58 Cl6 -","2","1","","Zhao, Zujin; Chen, Shuming; Lam, Jacky W. Y.; Wang, Zhiming; Lu, Ping; Mahtab, Faisal; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Kwok, Hoi Sing; Tang, Ben Zhong","Pyrene-substituted ethenes: aggregation-enhanced excimer emission and highly efficient electroluminescence","Journal of Materials Chemistry","2011","21","20","7210","","10.1039/c0jm04449k","","","1.54178","CuKα","","0.0875","0.0747","","","0.197","0.2066","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205933","17.2111","0.00016","6.750071","0.000064","13.23655","0.00012","90","","108.518","0.00064","90","","1458.15","0.02","298","","298","","","","","","","","","5","P 1 a 1","P -2ya","7","","","","- C4 H56 B8 Li4 N12 -","- C4 H56 B8 Li4 N12 -","- C8 H112 B16 Li8 N24 -","2","1","","Guo, Yanhui; Gu, Qinfen; Guo, Zaiping; Mao, Jianfeng; Liu, Huakun; Dou, Shixue; Yu, Xuebin","A GBH/LiBH4 coordination system with favorable dehydrogenation","Journal of Materials Chemistry","2011","21","20","7138","","10.1039/c0jm04485g","powder diffraction","","1.30419","synchrotron","","0.026","","","","","","","","1.948","","","","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7206039","9.396","0.0007","9.7337","0.0007","22.0591","0.0015","78.68","0.002","78.5522","0.0018","75.835","0.002","1893.9","0.2","93.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H20 B2 N4 -","- C24 H20 B2 N4 -","- C96 H80 B8 N16 -","4","2","","Kojima, Takahiro; Kumaki, Daisuke; Nishida, Jun-ichi; Tokito, Shizuo; Yamashita, Yoshiro","Organic field-effect transistors based on novel organic semiconductors containing diazaboroles","Journal of Materials Chemistry","2011","21","18","6607","","10.1039/c1jm00002k","","","0.71075","MoKα","","","0.0685","","","","0.208","","","","","","0.999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7206040","8.6051","0.0004","5.5304","0.0002","27.6946","0.0011","90","","97.8185","0.0016","90","","1305.72","0.09","93.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H28 B2 N4 -","- C36 H28 B2 N4 -","- C72 H56 B4 N8 -","2","0.5","","Kojima, Takahiro; Kumaki, Daisuke; Nishida, Jun-ichi; Tokito, Shizuo; Yamashita, Yoshiro","Organic field-effect transistors based on novel organic semiconductors containing diazaboroles","Journal of Materials Chemistry","2011","21","18","6607","","10.1039/c1jm00002k","","","0.71075","MoKα","","","0.0427","","","","0.1227","","","","","","1.082","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7206041","9.1177","0.0015","17.457","0.003","9.9165","0.0016","90","","100.715","0.002","90","","1550.9","0.4","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H18 O2 -","- C19 H18 O2 -","- C76 H72 O8 -","4","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0964","0.0563","","","0.1515","0.192","","","","","","1.024","","","","has coordinates,has disorder","180391","2020-10-21","18:00:00",""
"7206042","9.1419","0.0007","17.5398","0.0014","9.7526","0.0008","90","","99.8192","0.0013","90","","1540.9","0.2","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H18 O2 -","- C19 H18 O2 -","- C76 H72 O8 -","4","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0644","0.0391","","","0.1062","0.1254","","","","","","1.021","","","","has coordinates,has disorder","180391","2020-10-21","18:00:00",""
"7206043","10.0442","0.0004","13.8741","0.0005","30.5325","0.0012","90","","94.1613","0.0007","90","","4243.6","0.3","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H30 O2 -","- C25 H30 O2 -","- C200 H240 O16 -","8","2","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0624","0.0464","","","0.1125","0.1214","","","","","","1.044","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206044","7.6558","0.0004","17.7701","0.0009","12.6438","0.0006","90","","97.1985","0.0007","90","","1706.56","0.15","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 O2 -","- C22 H24 O2 -","- C88 H96 O8 -","4","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0412","0.0376","","","0.1058","0.1093","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206045","8.1422","0.0007","9.8073","0.0008","10.319","0.0009","80.8542","0.0013","87.0945","0.0013","86.9151","0.0013","811.61","0.12","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H22 O2 -","- C22 H22 O2 -","- C44 H44 O4 -","2","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0529","0.0425","","","0.1135","0.1244","","","","","","1.084","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206046","6.9024","0.0004","9.0519","0.0006","20.6141","0.0013","87.7209","0.001","82.2444","0.001","82.4091","0.001","1264.68","0.14","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C31 H42 O2 -","- C31 H42 O2 -","- C62 H84 O4 -","2","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0565","0.042","","","0.1182","0.1286","","","","","","1.089","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206047","17.3689","0.0007","6.3517","0.0002","17.6297","0.0007","90","","113.119","0.0005","90","","1788.74","0.12","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H24 O2 -","- C25 H24 O2 -","- C100 H96 O8 -","4","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.043","0.0394","","","0.1072","0.1109","","","","","","1.046","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206048","11.2996","0.0005","12.3091","0.0006","12.3511","0.0006","88.7806","0.0007","74.3156","0.0007","75.1626","0.0007","1596.65","0.13","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H20 O2 -","- C21 H20 O2 -","- C84 H80 O8 -","4","2","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0576","0.0442","","","0.109","0.1169","","","","","","1.036","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206049","11.2274","0.0004","7.6159","0.0003","14.2498","0.0005","90","","104.981","0.0005","90","","1177.04","0.07","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 O2 -","- C16 H12 O2 -","- C64 H48 O8 -","4","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0438","0.0405","","","0.1173","0.1207","","","","","","1.07","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206050","8.5056","0.0007","10.1688","0.0008","14.4684","0.0012","90","","90","","90","","1251.4","0.18","100","2","100","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C17 H14 O2 -","- C17 H14 O2 -","- C68 H56 O8 -","4","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.036","0.0335","","","0.0872","0.0895","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206051","16.5454","0.0012","7.5826","0.0005","22.0553","0.0015","90","","95.2065","0.0011","90","","2755.6","0.3","100","2","100","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- C18 H16 O2 -","- C18 H16 O2 -","- C144 H128 O16 -","8","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0765","0.0496","","","0.1117","0.1286","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206052","9.783","0.003","8.098","0.003","19.488","0.006","90","","97.331","0.005","90","","1531.3","0.9","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 O2 -","- C19 H18 O2 -","- C76 H72 O8 -","4","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0588","0.0401","","","0.1095","0.1279","","","","","","1.016","","","","has coordinates,has disorder","180391","2020-10-21","18:00:00",""
"7206053","7.8529","0.0004","8.5743","0.0004","11.4604","0.0006","87.9208","0.0008","80.4985","0.0008","67.0534","0.0007","700.52","0.06","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H16 O2 -","- C18 H16 O2 -","- C36 H32 O4 -","2","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0672","0.0482","","","0.1469","0.1676","","","","","","1.059","","","","has coordinates,has disorder","180391","2020-10-21","18:00:00",""
"7206054","8.6243","0.0007","9.3234","0.0008","10.7823","0.0009","113.309","0.0012","101.293","0.0012","93.6011","0.0013","771.27","0.11","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H20 O2 -","- C20 H20 O2 -","- C40 H40 O4 -","2","1","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0641","0.0432","","","0.1116","0.1276","","","","","","1.01","","","","has coordinates,has disorder","180391","2020-10-21","18:00:00",""
"7206055","9.1605","0.0002","9.6923","0.0002","10.218","0.0003","67.1901","0.0003","85.3952","0.0004","62.2311","0.0003","734.34","0.03","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H36 O4 -","- C38 H36 O4 -","- C38 H36 O4 -","1","0.5","","Zhu, Lingyan; Agarwal, Arun; Lai, Jinfeng; Al-Kaysi, Rabih O.; Tham, Fook S.; Ghaddar, Tarek; Mueller, Leonard; Bardeen, Christopher J.","Solid-state photochemical and photomechanical properties of molecular crystal nanorods composed of anthracene ester derivatives","Journal of Materials Chemistry","2011","21","17","6258","","10.1039/c1jm10228a","","","0.71073","MoKα","","0.0467","0.0415","","","0.111","0.1155","","","","","","1.056","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206056","5.9075","0.001","7.3979","0.0013","28.899","0.003","90","","90.592","0.001","90","","1262.9","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H48 Br N O2 -","- C22 H48 Br N O2 -","- C44 H96 Br2 N2 O4 -","2","1","","Wei, Zengbin; Wei, Xilian; Wang, Xiuhong; Wang, Zhongni; Liu, Jie","Ionic liquid crystals of quaternary ammonium salts with a 2-hydroxypropoxy insertion group","Journal of Materials Chemistry","2011","21","19","6875","","10.1039/c1jm10236b","","","0.71073","MoKα","","0.1723","0.0692","","","0.1202","0.1386","","","","","","0.995","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206057","5.6382","0.0006","7.2724","0.0007","26.007","0.002","90","","93.778","0.002","90","","1064.05","0.17","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H42 Br N -","- C19 H42 Br N -","- C38 H84 Br2 N2 -","2","1","","Wei, Zengbin; Wei, Xilian; Wang, Xiuhong; Wang, Zhongni; Liu, Jie","Ionic liquid crystals of quaternary ammonium salts with a 2-hydroxypropoxy insertion group","Journal of Materials Chemistry","2011","21","19","6875","","10.1039/c1jm10236b","","","0.71073","MoKα","","0.1109","0.0903","","","0.2336","0.26","","","","","","1.003","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206058","9.4051","0.0008","11.1593","0.001","14.825","0.0013","106.358","0.001","97.975","0.001","101.611","0.001","1430.5","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H30 N2 S -","- C39 H30 N2 S -","- C78 H60 N4 S2 -","2","1","","Zhang, Ying; Lai, Shiu-Lun; Tong, Qing-Xiao; Chan, Mei-Yee; Ng, Tsz-Wai; Wen, Zhi-Chun; Zhang, Guo-Qiang; Lee, Shuit-Tong; Kwong, Hoi-Lun; Lee, Chun-Sing","Synthesis and characterization of phenanthroimidazole derivatives for applications in organic electroluminescent devices","Journal of Materials Chemistry","2011","21","22","8206","","10.1039/c1jm10326a","","","0.71073","MoKα","","0.0497","0.0427","","","0.1212","0.1326","","","","","","1.073","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206059","6.7105","0.0009","11.6875","0.0015","15.534","0.002","79.793","0.002","85.714","0.002","74.038","0.002","1152.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","1-amino-4-methyl-1H-tetrazol-5(4H)-iminium 4-amino-3,5- dinitropyrazol-1-ide","1-amino-4-methyl-1H-tetrazol-5(4H)-iminium 4-amino-3,5-dinitropyrazol-1-ide","","- C5 H9 N11 O4 -","- C5 H9 N11 O4 -","- C20 H36 N44 O16 -","4","2","","Zhang, Yanqiang; Huang, Yangen; Parrish, Damon A.; Shreeve, Jean'ne M.","4-Amino-3,5-dinitropyrazolate salts—highly insensitive energetic materials","Journal of Materials Chemistry","2011","21","19","6891","","10.1039/c1jm10340g","","","0.71073","MoKα","","0.0401","0.0341","","","0.0874","0.0912","","","","","","1.033","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206060","12.571","0.002","9.381","0.0016","13.169","0.002","90","","97.658","0.002","90","","1539.2","0.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Carbonohydrazidium bis-4-amino-3,5-dinitropyrazol-1-ide","","- C7 H12 N14 O9 -","- C7 H12 N14 O9 -","- C28 H48 N56 O36 -","4","0.5","","Zhang, Yanqiang; Huang, Yangen; Parrish, Damon A.; Shreeve, Jean'ne M.","4-Amino-3,5-dinitropyrazolate salts—highly insensitive energetic materials","Journal of Materials Chemistry","2011","21","19","6891","","10.1039/c1jm10340g","","","0.71073","MoKα","","0.0338","0.0314","","","0.0808","0.083","","","","","","1.054","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206061","13.5377","0.0002","13.5377","0.0002","18.3726","0.0005","90","","90","","90","","3367.13","0.12","150","2","150","2","","","","","","","","7","P 4/n c c :2","-P 4a 2ac","130","","","","- C24 H36 Cu F6 N4 O10 Si -","- C24 H20 Cu F6 N4 O10 Si -","- C96 H80 Cu4 F24 N16 O40 Si4 -","4","0.25","","Wang, Sujuan; Li, Lei; Zhang, Jianyong; Yuan, Xiaochen; Su, Cheng-Yong","Anion-tuned sorption and catalytic properties of a soft metal‒organic solid with polycatenated frameworks","Journal of Materials Chemistry","2011","21","20","7098","","10.1039/c1jm10394f","","","1.54178","CuKα","","0.1167","0.0989","","","0.2311","0.2419","","","","","","1.012","","","","has coordinates,has disorder","180391","2020-10-21","18:00:00",""
"7206062","19.118","0.003","27.955","0.005","13.258","0.002","90","","123.128","0.006","90","","5933.9","1.7","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C35 H31 F6 -","- C35 H31 F6 -","- C280 H248 F48 -","8","1","","Lin, Sheng-Hsun; Wu, Fang-Iy; Tsai, Hsiu-Yun; Chou, Pei-Yu; Chou, Ho-Hsiu; Cheng, Chien-Hong; Liu, Rai-Shung","Highly efficient deep-blue organic electroluminescent devices doped with hexaphenylanthracene fluorophores","Journal of Materials Chemistry","2011","21","22","8122","","10.1039/c1jm10424a","","","0.71073","MoKα","","0.2254","0.0768","","","0.1674","0.2436","","","","","","0.963","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206063","13.9453","0.0003","19.2725","0.0004","24.4221","0.0005","90","","122.704","0.002","90","","5523.2","0.2","291","2","291","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C68 H47 Eu N2 O6 -","- C68 H47 Eu N2 O6 -","- C272 H188 Eu4 N8 O24 -","4","1","","Wang, Shimin; Zhang, Jiyuan; Hou, Yanhui; Du, Chenxia; Wu, Yangjie","4,5-Diaza-9,9′-spirobifluorene functionalized europium complex with efficient photo- and electro-luminescent properties","Journal of Materials Chemistry","2011","21","21","7559","","10.1039/c1jm10480b","","","0.7107","MoKα","","0.0484","0.0313","","","0.062","0.0691","","","","","","1.064","","","","has coordinates,has disorder","180391","2020-10-21","18:00:00",""
"7206064","45.265","0.004","8.3038","0.0008","9.1833","0.0009","90","","98.583","0.002","90","","3413.1","0.6","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H30 N2 O4 -","- C15 H30 N2 O4 -","- C120 H240 N16 O32 -","8","1","","Lin, Joseph C. Y.; Huang, Chao-June; Lee, Yi-Ting; Lee, Kwang-Ming; Lin, Ivan J. B.","Carboxylic acid functionalized imidazolium salts: sequential formation of ionic, zwitterionic, acid-zwitterionic and lithium salt-zwitterionic liquid crystals","Journal of Materials Chemistry","2011","21","22","8110","","10.1039/c1jm10580a","","","0.71073","MoKα","","0.0509","0.0433","","","0.1177","0.1305","","","","","","1.144","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206065","7.7796","0.0005","4.7083","0.0003","47.139","0.003","90","","91.573","0.003","90","","1725.99","0.19","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H27 Br N2 O2 -","- C15 H27 Br N2 O2 -","- C60 H108 Br4 N8 O8 -","4","1","","Lin, Joseph C. Y.; Huang, Chao-June; Lee, Yi-Ting; Lee, Kwang-Ming; Lin, Ivan J. B.","Carboxylic acid functionalized imidazolium salts: sequential formation of ionic, zwitterionic, acid-zwitterionic and lithium salt-zwitterionic liquid crystals","Journal of Materials Chemistry","2011","21","22","8110","","10.1039/c1jm10580a","","","0.71073","MoKα","","0.0653","0.0457","","","0.122","0.1381","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206066","8.5917","0.0005","14.2392","0.0014","17.7698","0.0016","95.665","0.01","98.824","0.01","103.551","0.01","2067.8","0.3","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H52 Br2 Si2 -","- C44 H52 Br2 Si2 -","- C88 H104 Br4 Si4 -","2","1","","Okamoto, Toshihiro; Jiang, Ying; Becerril, Hector A.; Hong, Sanghyun; Senatore, Michelle L.; Tang, Ming L.; Toney, Michael F.; Siegrist, Theo; Bao, Zhenan","Synthesis of regioregular pentacene-containing conjugated polymers","Journal of Materials Chemistry","2011","21","20","7078","","10.1039/c1jm10643k","","","0.71073","MoKα","","0.072","0.0417","","0.1088","0.1037","0.1088","","","","","","0.7655","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7206067","10.5231","0.0008","10.9713","0.0008","17.445","0.002","90.807","0.008","89.922","0.008","91.961","0.006","2012.7","0.3","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H52 Br2 Si2 -","- C44 H52 Br2 Si2 -","- C88 H104 Br4 Si4 -","2","1","","Okamoto, Toshihiro; Jiang, Ying; Becerril, Hector A.; Hong, Sanghyun; Senatore, Michelle L.; Tang, Ming L.; Toney, Michael F.; Siegrist, Theo; Bao, Zhenan","Synthesis of regioregular pentacene-containing conjugated polymers","Journal of Materials Chemistry","2011","21","20","7078","","10.1039/c1jm10643k","","","0.71073","MoKα","","0.1542","0.0489","","0.0823","0.0535","0.0535","","","","","","1.0662","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7206068","7.304","0.0015","9.1675","0.0018","9.5663","0.0019","90","","90","","90","","640.6","0.2","298","2","298","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- Ce H13 N3 O11 P3 -","- Ce H11 N3 O11 P3 -","- Ce2 H22 N6 O22 P6 -","2","0.5","","Yi, Jianglong; Fu, Zhiyong; Liao, Shijun; Song, Desheng; Dai, Jingcao","Nitrogen-containing porous cerium trimetaphosphimate as a new efficient base catalyst","Journal of Materials Chemistry","2011","21","17","6144","","10.1039/c1jm10669d","","","0.71073","MoKα","","0.0194","0.0191","","","0.0471","0.0473","","","","","","1.06","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7206069","15.264","0.003","12.908","0.003","24.867","0.005","90","","99.4","0.03","90","","4833.7","1.8","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H17 N6 O4.5 Zn -","- C26 H17 N6 O4.5 Zn -","- C208 H136 N48 O36 Zn8 -","8","1","","Fu, Zhiyong; Chen, Yuan; Zhang, Jie; Liao, Shijun","Correlation between the photoactive character and the structures of two novel metal organic frameworks","Journal of Materials Chemistry","2011","21","22","7895","","10.1039/c1jm10945f","","","0.71073","MoKα","","0.0588","0.0331","","","0.0781","0.0975","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7206070","10.106","0.002","20.726","0.004","16.394","0.003","90","","93.71","0.03","90","","3426.6","1.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H22 N6 O9 Zn2 -","- C34 H22 N6 O9 Zn2 -","- C136 H88 N24 O36 Zn8 -","4","1","","Fu, Zhiyong; Chen, Yuan; Zhang, Jie; Liao, Shijun","Correlation between the photoactive character and the structures of two novel metal organic frameworks","Journal of Materials Chemistry","2011","21","22","7895","","10.1039/c1jm10945f","","","0.71073","MoKα","","0.0787","0.053","","","0.138","0.173","","","","","","1.059","","","","has coordinates","180391","2020-10-21","18:00:00",""
"7206168","5.4497","0.0004","7.4823","0.0007","16.7814","0.0013","90","","95.212","0.008","90","","681.45","0.1","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H7 N3 O3 S -","- C3 H7 N3 O3 S -","- C12 H28 N12 O12 S4 -","4","1","","Luo, Jiangshui; Hu, Jin; Saak, Wolfgang; Beckhaus, Rüdiger; Wittstock, Gunther; Vankelecom, Ivo F. J.; Agert, Carsten; Conrad, Olaf","Protic ionic liquid and ionic melts prepared from methanesulfonic acid and 1H-1,2,4-triazole as high temperature PEMFC electrolytes","Journal of Materials Chemistry","2011","21","28","10426","","10.1039/c0jm04306k","","","0.71073","MoKα","","0.0466","0.0273","","","0.054","0.0574","","","","","","0.881","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206350","14.7078","0.0011","10.1581","0.0008","17.88","0.0014","90","","105.789","0.001","90","","2570.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H36 Fe N3 S6 -","- C18 H36 Fe N3 S6 -","- C72 H144 Fe4 N12 S24 -","4","1","","Akhtar, Masood; Akhter, Javeed; Malik, M. Azad; O'Brien, Paul; Tuna, Floriana; Raftery, James; Helliwell, Madeleine","Deposition of iron sulfide nanocrystals from single source precursors","Journal of Materials Chemistry","2011","21","26","9737","","10.1039/c1jm10703h","","","0.71073","MoKα","","0.0644","0.0539","","","0.1175","0.1236","","","","","","1.139","","","","has coordinates","180394","2020-10-21","18:00:00",""
"7206351","7.974","0.002","11.999","0.003","12.112","0.003","76.157","0.005","79.844","0.005","83.699","0.005","1104.8","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H28 Fe N3 O0.5 S6 -","- C14 H28 Fe N3 O0.5 S6 -","- C28 H56 Fe2 N6 O S12 -","2","1","","Akhtar, Masood; Akhter, Javeed; Malik, M. Azad; O'Brien, Paul; Tuna, Floriana; Raftery, James; Helliwell, Madeleine","Deposition of iron sulfide nanocrystals from single source precursors","Journal of Materials Chemistry","2011","21","26","9737","","10.1039/c1jm10703h","","","0.71073","MoKα","","0.0891","0.0618","","","0.1455","0.1589","","","","","","1.049","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7206352","7.074","0.0003","10.1883","0.0004","13.977","0.0005","80.255","0.003","87.742","0.003","89.718","0.003","992.04","0.07","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H21 Br2 N -","- C22 H21 Br2 N -","- C44 H42 Br4 N2 -","2","1","","Keyworth, Colin W.; Chan, Khai Leok; Labram, John G.; Anthopoulos, Thomas D.; Watkins, Scott E.; McKiernan, Mary; White, Andrew J. P.; Holmes, Andrew B.; Williams, Charlotte K.","The tuning of the energy levels of dibenzosilole copolymers and applications in organic electronics","Journal of Materials Chemistry","2011","21","32","11800","","10.1039/c1jm11242b","","","1.54184","CuKα","","0.0436","0.0364","","","0.0963","0.1005","","","","","","1.075","","","","has coordinates,has disorder","180394","2020-10-21","18:00:00",""
"7206353","19.3994","0.0004","9.571","0.0002","28.8219","0.0007","90","","100.402","0.002","90","","5263.5","0.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H29 Br2 N3 O -","- C28 H29 Br2 N3 O -","- C224 H232 Br16 N24 O8 -","8","1","","Keyworth, Colin W.; Chan, Khai Leok; Labram, John G.; Anthopoulos, Thomas D.; Watkins, Scott E.; McKiernan, Mary; White, Andrew J. P.; Holmes, Andrew B.; Williams, Charlotte K.","The tuning of the energy levels of dibenzosilole copolymers and applications in organic electronics","Journal of Materials Chemistry","2011","21","32","11800","","10.1039/c1jm11242b","","","0.71073","MoKα","","0.0673","0.0345","","","0.0714","0.0745","","","","","","0.925","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206354","15.5726","0.001","20.4685","0.0013","20.6449","0.0013","65.399","0.001","74.616","0.001","82.172","0.001","5766.3","0.6","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H36 Br24 Cl5 O12 Si8 -","- C54 H20 Br24 Cl2 O12 Si8 -","- C108 H40 Br48 Cl4 O24 Si16 -","2","1","","Roll, Mark F.; Mathur, Priyanka; Takahashi, Kunio; Kampf, Jeffrey W.; Laine, R. M.","[PhSiO1.5]8 promotes self-bromination to produce [o-BrPhSiO1.5]8: further bromination gives crystalline [2,5-Br2PhSiO1.5]8 with a density of 2.32 g cm−3 and a calculated refractive index of 1.7 or the tetraicosa bromo compound [Br3PhSiO1.5]8","Journal of Materials Chemistry","2011","21","30","11167","","10.1039/c1jm11536g","","","0.71073","MoKα","","0.0757","0.0629","","","0.1935","0.2024","","","","","","1.089","","","","has coordinates,has disorder","180394","2020-10-21","18:00:00",""
"7206355","12.7172","0.0009","12.7392","0.0009","13.089","0.0009","97.592","0.001","109.075","0.001","116.231","0.001","1699.3","0.2","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H24 Br16 O12 S2 Si8 -","- C49 H24 Br16 O12 S2 Si8 -","- C49 H24 Br16 O12 S2 Si8 -","1","0.5","","Roll, Mark F.; Mathur, Priyanka; Takahashi, Kunio; Kampf, Jeffrey W.; Laine, R. M.","[PhSiO1.5]8 promotes self-bromination to produce [o-BrPhSiO1.5]8: further bromination gives crystalline [2,5-Br2PhSiO1.5]8 with a density of 2.32 g cm−3 and a calculated refractive index of 1.7 or the tetraicosa bromo compound [Br3PhSiO1.5]8","Journal of Materials Chemistry","2011","21","30","11167","","10.1039/c1jm11536g","","","0.71073","MoKα","","0.0313","0.027","","","0.0742","0.0765","","","","","","1.045","","","","has coordinates,has disorder","180394","2020-10-21","18:00:00",""
"7206356","20.5738","0.001","20.5738","0.001","36.261","0.004","90","","90","","90","","15349","2","85","2","85","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H57 Br8 O12 Si8 -","- C64 H52 Br8 O12 Si8 -","- C512 H416 Br64 O96 Si64 -","8","0.5","","Roll, Mark F.; Mathur, Priyanka; Takahashi, Kunio; Kampf, Jeffrey W.; Laine, R. M.","[PhSiO1.5]8 promotes self-bromination to produce [o-BrPhSiO1.5]8: further bromination gives crystalline [2,5-Br2PhSiO1.5]8 with a density of 2.32 g cm−3 and a calculated refractive index of 1.7 or the tetraicosa bromo compound [Br3PhSiO1.5]8","Journal of Materials Chemistry","2011","21","30","11167","","10.1039/c1jm11536g","","","0.71073","MoKα","","0.0626","0.0526","","","0.146","0.153","","","","","","1.089","","","","has coordinates,has disorder","180394","2020-10-21","18:00:00",""
"7206454","13.9545","0.0014","7.8076","0.0008","19.5196","0.0019","90","","109.685","0.001","90","","2002.4","0.3","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H19 N O2 Pt -","- C26 H19 N O2 Pt -","- C104 H76 N4 O8 Pt4 -","4","1","","Mou, Xin; Wu, Yongquan; Liu, Shujuan; Shi, Mei; Liu, Xiangmei; Wang, Chuanming; Sun, Shi; Zhao, Qiang; Zhou, Xinhui; Huang, Wei","Phosphorescent platinum(ii) complexes containing different β-diketonate ligands: synthesis, tunable excited-state properties, and their application in bioimaging","Journal of Materials Chemistry","2011","21","36","13951","","10.1039/c1jm10718f","","","0.71073","MoKα","","0.052","0.0435","","","0.1018","0.113","","","","","","1.017","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206455","13.0708","0.0013","13.4331","0.0013","26.062","0.003","93.161","0.001","98.284","0.001","117.916","0.001","3961.8","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C86 H118 N2 O12 -","- C86 H118 N2 O12 -","- C172 H236 N4 O24 -","2","1","","Liang, Qing; Chen, Guosong; Guan, Bing; Jiang, Ming","Structural factors of amphiphilic calix[6]biscrowns affecting their vesicle‒nanotube transitions in self-assembly","Journal of Materials Chemistry","2011","21","35","13262","","10.1039/c1jm10895f","","","0.71073","MoKα","","0.0752","0.0595","","","0.1791","0.2039","","","","","","1.023","","","","has coordinates,has disorder","180395","2020-10-21","18:00:00",""
"7206456","12.992","0.003","13.924","0.003","18.886","0.004","95.33","0.03","91.63","0.03","92.2","0.03","3397.4","1.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H43 N3 O2 Pd -","- C37 H43 N3 O2 Pd -","- C148 H172 N12 O8 Pd4 -","4","2","","Ghedini, Mauro; Golemme, Attilio; Aiello, Iolinda; Godbert, Nicolas; Termine, Roberto; Crispini, Alessandra; La Deda, Massimo; Lelj, Francesco; Amati, Mario; Belviso, Sandra","Liaisons between photoconductivity and molecular frame in organometallic Pd(ii) and Pt(ii) complexes","Journal of Materials Chemistry","2011","21","35","13434","","10.1039/c1jm11926e","","","0.71073","MoKα","","0.0743","0.04","","","0.0914","0.1013","","","","","","0.897","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206457","12.833","0.007","13.736","0.007","20.058","0.011","101.049","0.011","107.842","0.01","90.996","0.01","3292","3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H43 N3 O2 Pt -","- C37 H43 N3 O2 Pt -","- C148 H172 N12 O8 Pt4 -","4","2","","Ghedini, Mauro; Golemme, Attilio; Aiello, Iolinda; Godbert, Nicolas; Termine, Roberto; Crispini, Alessandra; La Deda, Massimo; Lelj, Francesco; Amati, Mario; Belviso, Sandra","Liaisons between photoconductivity and molecular frame in organometallic Pd(ii) and Pt(ii) complexes","Journal of Materials Chemistry","2011","21","35","13434","","10.1039/c1jm11926e","","","0.71073","MoKα","","0.0502","0.0295","","","0.066","0.0766","","","","","","1.031","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206458","5.9863","0.0004","8.2081","0.0007","32.135","0.003","94.509","0.004","92.828","0.004","92.317","0.004","1570.6","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H42 N2 O2 Pd -","- C36 H42 N2 O2 Pd -","- C72 H84 N4 O4 Pd2 -","2","1","","Ghedini, Mauro; Golemme, Attilio; Aiello, Iolinda; Godbert, Nicolas; Termine, Roberto; Crispini, Alessandra; La Deda, Massimo; Lelj, Francesco; Amati, Mario; Belviso, Sandra","Liaisons between photoconductivity and molecular frame in organometallic Pd(ii) and Pt(ii) complexes","Journal of Materials Chemistry","2011","21","35","13434","","10.1039/c1jm11926e","","","0.71073","MoKα","","0.0516","0.0366","","","0.0848","0.1014","","","","","","1.154","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206459","6.0027","0.0004","8.1666","0.0005","32.286","0.002","94.534","0.002","93.089","0.002","92.243","0.002","1573.97","0.17","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H42 N2 O2 Pt -","- C36 H42 N2 O2 Pt -","- C72 H84 N4 O4 Pt2 -","2","1","","Ghedini, Mauro; Golemme, Attilio; Aiello, Iolinda; Godbert, Nicolas; Termine, Roberto; Crispini, Alessandra; La Deda, Massimo; Lelj, Francesco; Amati, Mario; Belviso, Sandra","Liaisons between photoconductivity and molecular frame in organometallic Pd(ii) and Pt(ii) complexes","Journal of Materials Chemistry","2011","21","35","13434","","10.1039/c1jm11926e","","","0.71073","MoKα","","0.0342","0.0335","","","0.0695","0.0697","","","","","","1.44","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206460","4.6471","0.0008","20.92","0.003","10.636","0.0018","90","","92.743","0.003","90","","1032.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H4 Br N3 S2 -","- C9 H4 Br N3 S2 -","- C36 H16 Br4 N12 S8 -","4","1","","Welch, Gregory C.; Perez, Louis A.; Hoven, Corey V.; Zhang, Yuan; Dang, Xuan-Dung; Sharenko, Alexander; Toney, Michael F.; Kramer, Edward J.; Nguyen, Thuc-Quyen; Bazan, Guillermo C.","A modular molecular framework for utility in small-molecule solution-processed organic photovoltaic devices","Journal of Materials Chemistry","2011","21","34","12700","","10.1039/c1jm11963j","","","0.71073","MoKα","","0.0703","0.0412","","","0.096","0.1047","","","","","","0.945","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206461","18.817","0.004","7.9805","0.0017","28.301","0.006","90","","107.018","0.003","90","","4063.8","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H44 N6 S6 Si -","- C42 H44 N6 S6 Si -","- C168 H176 N24 S24 Si4 -","4","1","","Welch, Gregory C.; Perez, Louis A.; Hoven, Corey V.; Zhang, Yuan; Dang, Xuan-Dung; Sharenko, Alexander; Toney, Michael F.; Kramer, Edward J.; Nguyen, Thuc-Quyen; Bazan, Guillermo C.","A modular molecular framework for utility in small-molecule solution-processed organic photovoltaic devices","Journal of Materials Chemistry","2011","21","34","12700","","10.1039/c1jm11963j","","","0.71073","MoKα","","0.137","0.0841","","","0.1942","0.2111","","","","","","1.664","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206462","6.177","0.002","7.001","0.003","28.415","0.01","90","","94.4","0.03","90","","1225.2","0.8","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C14 H10 Cl N O3 -","- C14 H10 Cl N O3 -","- C56 H40 Cl4 N4 O12 -","4","0.5","","Song, Panshu; Chen, Xiaotong; Xiang, Yu; Huang, Lei; Zhou, Zhaojuan; Wei, Ruirui; Tong, Aijun","A ratiometric fluorescent pH probe based on aggregation-induced emission enhancement and its application in live-cell imaging","Journal of Materials Chemistry","2011","21","35","13470","","10.1039/c1jm12098k","","","0.71073","MoKα","","0.1925","0.0808","","","0.1405","0.1787","","","","","","1.093","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206463","12.4255","0.0008","14.4075","0.0008","13.4165","0.0007","90","","107.989","0.001","90","","2284.4","0.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 Cl F N5 O S -","- C24 H19 Cl F N5 O S -","- C96 H76 Cl4 F4 N20 O4 S4 -","4","1","","Guo, Jixi; Jia, Dianzeng; Liu, Lang; Yuan, Hui; Guo, Mingxi; Wu, Dongling; Li, Feng","Photochromism and mechanism of pyrazolones in crystals: structural variations directly observed by X-ray diffraction","Journal of Materials Chemistry","2011","21","33","12202","","10.1039/c1jm12267c","","","0.71073","MoKα","","0.1091","0.0699","","","0.1843","0.2482","","","","","","1.086","","","","has coordinates,has disorder","180395","2020-10-21","18:00:00",""
"7206464","12.4127","0.0016","14.397","0.0018","13.3934","0.0014","90","","108.02","0.002","90","","2276.1","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 Cl F N5 O S -","- C24 H19 Cl F N5 O S -","- C96 H76 Cl4 F4 N20 O4 S4 -","4","1","","Guo, Jixi; Jia, Dianzeng; Liu, Lang; Yuan, Hui; Guo, Mingxi; Wu, Dongling; Li, Feng","Photochromism and mechanism of pyrazolones in crystals: structural variations directly observed by X-ray diffraction","Journal of Materials Chemistry","2011","21","33","12202","","10.1039/c1jm12267c","","","0.71073","MoKα","","0.0949","0.0667","","","0.1948","0.2285","","","","","","1.074","","","","has coordinates","180395","2020-10-21","18:00:00",""
"7206471","11.264","0.004","6.189","0.002","17.301","0.006","90","","102.785","0.007","90","","1176.2","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H34 Br N O -","- C27 H34 Br N O -","- C54 H68 Br2 N2 O2 -","2","1","","Sui, Yan; Liu, Dong-Sheng; Hu, Rong-Hua; Chen, Hong-Mei","Discovery of a new type of organic ferroelectric materials in natural biomass dehydroabietylamine Schiff bases","Journal of Materials Chemistry","2011","21","38","14599","","10.1039/c0jm03461d","","","0.71073","MoKα","","0.0875","0.0526","","","0.1142","0.1191","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7206472","11.158","0.0017","6.2046","0.001","17.347","0.003","90","","101.49","0.003","90","","1176.9","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H34 N2 O3 -","- C27 H34 N2 O3 -","- C54 H68 N4 O6 -","2","1","","Sui, Yan; Liu, Dong-Sheng; Hu, Rong-Hua; Chen, Hong-Mei","Discovery of a new type of organic ferroelectric materials in natural biomass dehydroabietylamine Schiff bases","Journal of Materials Chemistry","2011","21","38","14599","","10.1039/c0jm03461d","","","0.71073","MoKα","","0.1393","0.047","","","0.0867","0.0986","","","","","","0.989","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7206584","25.731","0.0016","8.072","0.0007","18.411","0.0016","90","","106.441","0.003","90","","3667.6","0.5","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C19 H20 Au N4 -","- C19 H20 Au N4 -","- C152 H160 Au8 N32 -","8","2","","Lacroix, Pascal G.; Munoz, M. Carmen; Gaspar, Ana Belén; Real, José Antonio; Bonhommeau, Sébastien; Rodriguez, Vincent; Nakatani, Keitaro","Synthesis, crystal structures, and solid state quadratic nonlinear optical properties of a series of stilbazolium cations combined with gold cyanide counter-ion","Journal of Materials Chemistry","2011","21","40","15940","","10.1039/c1jm12105g","","","0.71073","MoKα","","0.1041","0.0522","","","0.0911","0.1114","","","","","","1.046","","","","has coordinates","180396","2020-10-21","18:00:00",""
"7206585","6.615","0.0003","7.661","0.0003","10.267","0.0006","83.806","0.002","83.545","0.002","77.497","0.003","502.87","0.04","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C21 H23 Au N4 O -","- C21 H22 Au N4 O -","- C21 H22 Au N4 O -","1","1","","Lacroix, Pascal G.; Munoz, M. Carmen; Gaspar, Ana Belén; Real, José Antonio; Bonhommeau, Sébastien; Rodriguez, Vincent; Nakatani, Keitaro","Synthesis, crystal structures, and solid state quadratic nonlinear optical properties of a series of stilbazolium cations combined with gold cyanide counter-ion","Journal of Materials Chemistry","2011","21","40","15940","","10.1039/c1jm12105g","","","0.71073","MoKα","","0.0394","0.036","","","0.0948","0.0981","","","","","","1.017","","","","has coordinates","180396","2020-10-21","18:00:00",""
"7206586","6.6997","0.0003","7.3685","0.0004","22.4087","0.0012","90","","93.852","0.005","90","","1103.75","0.1","100","2","100","2","","","","","","","Simon Dalgleish","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H9 N O S2 -","- C12 H9 N O S2 -","- C48 H36 N4 O4 S8 -","4","1","","Dalgleish, Simon; Labram, John G.; Li, Zhe; Wang, Jianpu; McNeill, Christopher R.; Anthopoulos, Thomas D.; Greenham, Neil C.; Robertson, Neil","Indole-substituted nickel dithiolene complexes in electronic and optoelectronic devices","Journal of Materials Chemistry","2011","21","39","15422","","10.1039/c1jm12466h","","","1.5418","CuKα","","0.0772","0.0674","","","0.1751","0.1799","","","","","","1.161","","","","has coordinates","180396","2020-10-21","18:00:00",""
"7206587","4.3101","0.00013","15.691","0.0004","21.4795","0.0007","90","","91.526","0.003","90","","1452.14","0.07","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 N2 Ni S4 -","- C30 H34 N2 Ni S4 -","- C60 H68 N4 Ni2 S8 -","2","0.5","","Dalgleish, Simon; Labram, John G.; Li, Zhe; Wang, Jianpu; McNeill, Christopher R.; Anthopoulos, Thomas D.; Greenham, Neil C.; Robertson, Neil","Indole-substituted nickel dithiolene complexes in electronic and optoelectronic devices","Journal of Materials Chemistry","2011","21","39","15422","","10.1039/c1jm12466h","","","0.71073","MoKα","","0.0592","0.0458","","0.1299","0.1257","0.1299","","","","","","1.0064","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7206588","8.22","0.005","8.96","0.007","13.113","0.007","74.48","0.02","75.97","0.02","65.43","0.03","836.8","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H30 B2 N2 O4 -","- C44 H30 B2 N2 O4 -","- C44 H30 B2 N2 O4 -","1","0.5","","Li, Di; Wang, Kai; Huang, Shuo; Qu, Songnan; Liu, Xingyuan; Zhu, Qingxin; Zhang, Hongyu; Wang, Yue","Brightly fluorescent red organic solids bearing boron-bridged π‒conjugated skeletons","Journal of Materials Chemistry","2011","21","39","15298","","10.1039/c1jm12498f","","","0.71073","MoKα","","0.1801","0.0786","","","0.1304","0.1631","","","","","","1.015","","","","has coordinates","180396","2020-10-21","18:00:00",""
"7206589","9.813","0.007","10.072","0.006","10.185","0.006","85.79","0.02","77.07","0.02","63.68","0.02","879","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H30 B2 N2 O2 S2 -","- C44 H30 B2 N2 O2 S2 -","- C44 H30 B2 N2 O2 S2 -","1","0.5","","Li, Di; Wang, Kai; Huang, Shuo; Qu, Songnan; Liu, Xingyuan; Zhu, Qingxin; Zhang, Hongyu; Wang, Yue","Brightly fluorescent red organic solids bearing boron-bridged π‒conjugated skeletons","Journal of Materials Chemistry","2011","21","39","15298","","10.1039/c1jm12498f","","","0.71073","MoKα","","0.1013","0.0549","","","0.1064","0.123","","","","","","1.017","","","","has coordinates","180396","2020-10-21","18:00:00",""
"7206590","9.7047","0.0019","29.019","0.006","16.265","0.003","90","","101.76","0.03","90","","4484.4","1.6","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C47 H37 Cl3 Cu F6 N2 O P3 -","- C47 H37 Cl3 Cu F6 N2 O P3 -","- C188 H148 Cl12 Cu4 F24 N8 O4 P12 -","4","1","","Costa, Rubén D.; Tordera, Daniel; Ortí, Enrique; Bolink, Henk J.; Schönle, Jonas; Graber, Stefan; Housecroft, Catherine E.; Constable, Edwin C.; Zampese, Jennifer A.","Copper(i) complexes for sustainable light-emitting electrochemical cells","Journal of Materials Chemistry","2011","21","40","16108","","10.1039/c1jm12607e","","","0.71073","MoKα","","0.0434","0.041","","","0.1094","0.1115","","","","","","1.048","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7206591","16.487","0.003","11.005","0.002","20.886","0.004","90","","104.93","0.03","90","","3661.6","1.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 Cu F6 N2 P3 -","- C40 H32 Cu F6 N2 P3 -","- C160 H128 Cu4 F24 N8 P12 -","4","1","","Costa, Rubén D.; Tordera, Daniel; Ortí, Enrique; Bolink, Henk J.; Schönle, Jonas; Graber, Stefan; Housecroft, Catherine E.; Constable, Edwin C.; Zampese, Jennifer A.","Copper(i) complexes for sustainable light-emitting electrochemical cells","Journal of Materials Chemistry","2011","21","40","16108","","10.1039/c1jm12607e","","","0.71073","MoKα","","0.0448","0.0384","","","0.089","0.0921","","","","","","1.103","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7206592","13.4327","0.001","25.218","0.002","13.6483","0.0009","90","","105.808","0.005","90","","4448.5","0.6","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C49 H38 Cl2 Cu F6 N2 O P3 -","- C49 H38 Cl2 Cu F6 N2 O P3 -","- C196 H152 Cl8 Cu4 F24 N8 O4 P12 -","4","1","","Costa, Rubén D.; Tordera, Daniel; Ortí, Enrique; Bolink, Henk J.; Schönle, Jonas; Graber, Stefan; Housecroft, Catherine E.; Constable, Edwin C.; Zampese, Jennifer A.","Copper(i) complexes for sustainable light-emitting electrochemical cells","Journal of Materials Chemistry","2011","21","40","16108","","10.1039/c1jm12607e","","","0.71073","MoKα","","0.0381","0.0347","","","0.0817","0.0836","","","","","","1.106","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7206593","12.4818","0.0015","13.445","0.0015","15.0834","0.0018","86.429","0.009","67.721","0.009","62.963","0.008","2067.6","0.5","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C89 H78 Cl2 Cu2 F12 N4 O2 P6 -","- C89 H76 Cl2 Cu2 F12 N4 O2 P6 -","- C89 H76 Cl2 Cu2 F12 N4 O2 P6 -","1","0.5","","Costa, Rubén D.; Tordera, Daniel; Ortí, Enrique; Bolink, Henk J.; Schönle, Jonas; Graber, Stefan; Housecroft, Catherine E.; Constable, Edwin C.; Zampese, Jennifer A.","Copper(i) complexes for sustainable light-emitting electrochemical cells","Journal of Materials Chemistry","2011","21","40","16108","","10.1039/c1jm12607e","","","0.71073","MoKα","","0.0548","0.0511","","","0.1385","0.1409","","","","","","1.114","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7206594","10.8137","0.0013","19.04","0.002","19.246","0.004","90","","98.338","0.011","90","","3920.7","1","208","2","208","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H44 Eu2 Mo N12 O17 -","- C25 H42 Eu2 Mo N12 O17 -","- C100 H168 Eu8 Mo4 N48 O68 -","4","1","","Tanase, Stefania; Mittelmeijer-Hazeleger, Marjo C.; Rothenberg, Gadi; Mathonière, Corine; Jubera, Véronique; Smits, Jan M. M.; de Gelder, René","A facile building-block synthesis of multifunctional lanthanide MOFs","Journal of Materials Chemistry","2011","21","39","15544","","10.1039/c1jm12789f","","","0.71073","MoKα","","0.0511","0.0378","","0.0873","0.0813","0.0873","","","1.219","","","1.219","","","","has coordinates,has disorder","180396","2020-10-21","18:00:00",""
"7206595","21.6623","0.0019","21.6623","0.0019","21.6623","0.0019","90","","90","","90","","10165.1","1.5","296","2","296","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C30 H18 N3 Ni3 O13 -","- C30 H18 N3 Ni3 O13 -","- C240 H144 N24 Ni24 O104 -","8","0.166667","","Ren, Guojian; Liu, Shuxia; Ma, Fengji; Wei, Feng; Tang, Qun; Yang, Yuan; Liang, Dadong; Li, Shujun; Chen, Yaguang","A 9-connected metal‒organic framework with gas adsorption properties","Journal of Materials Chemistry","2011","21","40","15909","","10.1039/c1jm12834e","","","0.71073","MoKα","","0.0559","0.0388","","","0.058","0.061","","","","","","0.903","","","","has coordinates","180396","2020-10-21","18:00:00",""
"7206773","5.5337","0.0012","7.9622","0.0019","16.321","0.003","101.835","0.006","94.236","0.007","93.967","0.006","699.3","0.3","93.1","","93.1","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H10 B F3 N2 O2 -","- C17 H10 B F3 N2 O2 -","- C34 H20 B2 F6 N4 O4 -","2","1","","Nishida, Jun-ichi; Fujita, Tomohiro; Fujisaki, Yoshihide; Tokito, Shizuo; Yamashita, Yoshiro","Diazaboroles with quinone units: hydrogen bonding network and n-type FETs involving a three-coordinate boron atom","Journal of Materials Chemistry","2011","21","41","16442","","10.1039/c1jm12650d","","","0.71075","MoKα","","","0.1265","","","","0.3359","","","","","","1.022","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7206774","11.23","0.006","5.578","0.003","11.275","0.006","90","","108.863","0.009","90","","668.3","0.6","396","2","396","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 -","- C20 H18 -","- C40 H36 -","2","0.5","","Li, Jinpeng; Takaishi, Shinya; Fujinuma, Naohiro; Endo, Katsutoshi; Yamashita, Masahiro; Matsuzaki, Hiroyuki; Okamoto, Hiroshi; Sawabe, Kosuke; Takenobu, Taishi; Iwasa, Yoshihiro","Enhancement of luminescence intensity in TMPY/perylene co-single crystals","Journal of Materials Chemistry","2011","21","44","17662","","10.1039/c1jm12977e","","","0.71073","MoKα","","0.0983","0.0585","","","0.1388","0.1576","","","","","","0.968","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206775","11.1814","0.0016","5.6056","0.0008","11.1539","0.0016","90","","109.102","0.003","90","","660.61","0.16","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17.24 -","- C20 H17.244 -","- C40 H34.488 -","2","0.5","","Li, Jinpeng; Takaishi, Shinya; Fujinuma, Naohiro; Endo, Katsutoshi; Yamashita, Masahiro; Matsuzaki, Hiroyuki; Okamoto, Hiroshi; Sawabe, Kosuke; Takenobu, Taishi; Iwasa, Yoshihiro","Enhancement of luminescence intensity in TMPY/perylene co-single crystals","Journal of Materials Chemistry","2011","21","44","17662","","10.1039/c1jm12977e","","","0.71073","MoKα","","0.0909","0.0771","","","0.1806","0.1891","","","","","","1.203","","","","has coordinates,has disorder","180398","2020-10-21","18:00:00",""
"7206776","10.9144","0.0009","12.0768","0.001","12.3039","0.001","87.544","0.002","76.692","0.002","78.457","0.002","1546.3","0.2","114","2","114","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H48 N6 O12 Pr2 -","- C78 H48 N6 O12 Pr2 -","- C78 H48 N6 O12 Pr2 -","1","0.5","","Katkova, Marina A.; Pushkarev, Anatoly P.; Balashova, Tatyana V.; Konev, Alexey N.; Fukin, Georgy K.; Ketkov, Sergey Yu.; Bochkarev, Mikhail N.","Near-infrared electroluminescent lanthanide [Pr(iii), Nd(iii), Ho(iii), Er(iii), Tm(iii), and Yb(iii)] N,O-chelated complexes for organic light-emitting devices","Journal of Materials Chemistry","2011","21","41","16611","","10.1039/c1jm13023d","","","0.71073","MoKα","","0.0382","0.0302","","","0.0676","0.0697","","","","","","1.023","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206777","10.897","0.004","12.075","0.004","12.226","0.004","87.938","0.007","76.842","0.006","78.844","0.008","1536.8","0.9","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H54 N12 Nd2 O6 -","- C78 H54 N12 Nd2 O6 -","- C78 H54 N12 Nd2 O6 -","1","0.5","","Katkova, Marina A.; Pushkarev, Anatoly P.; Balashova, Tatyana V.; Konev, Alexey N.; Fukin, Georgy K.; Ketkov, Sergey Yu.; Bochkarev, Mikhail N.","Near-infrared electroluminescent lanthanide [Pr(iii), Nd(iii), Ho(iii), Er(iii), Tm(iii), and Yb(iii)] N,O-chelated complexes for organic light-emitting devices","Journal of Materials Chemistry","2011","21","41","16611","","10.1039/c1jm13023d","","","0.71073","MoKα","","0.1161","0.0842","","","0.1981","0.2134","","","","","","1.043","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206778","7.952","0.002","11.127","0.003","11.142","0.003","65.992","0.006","72.469","0.005","79.123","0.006","856.3","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H56 Cu N6 O2 S2 -","- C28 H56 Cu N6 O2 S2 -","- C28 H56 Cu N6 O2 S2 -","1","0.5","","Abdelhady, Ahmed Lutfi; Ramasamy, Karthik; Malik, Mohammad Azad; O'Brien, Paul; Haigh, Sarah J.; Raftery, James","New routes to copper sulfide nanostructures and thin films","Journal of Materials Chemistry","2011","21","44","17888","","10.1039/c1jm13277f","","","0.71073","MoKα","","0.1681","0.0471","","","0.0682","0.0896","","","","","","0.491","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206779","11.401","0.005","11.288","0.005","17.046","0.007","90","","90.54","0.03","90","","2193.6","1.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H21 Cl O5 -","- C28 H21 Cl O5 -","- C112 H84 Cl4 O20 -","4","1","","Avó, João; Parola, A. Jorge; Lima, João C.; Pina, Fernando; Cunha-Silva, Luís","Phase transition thermochromism based on C‒H acidity of 4-alkylflavylium compounds in Pluronic F-127","Journal of Materials Chemistry","2011","21","41","16628","","10.1039/c1jm13348a","","","0.71073","MoKα","","0.0873","0.0787","","","0.165","0.168","","","","","","1.307","","","","has coordinates,has disorder","180398","2020-10-21","18:00:00",""
"7206780","12.869","0.005","23.643","0.01","24.9","0.011","90","","90","","90","","7576","5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C12 H10 Cd N4 O4 -","- C12 H10 Cd N4 O4 -","- C192 H160 Cd16 N64 O64 -","16","0.5","","Pachfule, Pradip; Chen, Yifei; Jiang, Jianwen; Banerjee, Rahul","Experimental and computational approach of understanding the gas adsorption in amino functionalized interpenetrated metal organic frameworks (MOFs)","Journal of Materials Chemistry","2011","21","44","17737","","10.1039/c1jm13762j","","","0.71073","MoKα","","0.0682","0.0653","","","0.1824","0.1861","","","","","","1.165","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206781","12.819","0.002","23.058","0.004","23.654","0.004","90","","90","","90","","6992","2","200","2","200","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C12 H10 Co N4 O4 -","- C12 H10 Co N4 O4 -","- C192 H160 Co16 N64 O64 -","16","0.5","","Pachfule, Pradip; Chen, Yifei; Jiang, Jianwen; Banerjee, Rahul","Experimental and computational approach of understanding the gas adsorption in amino functionalized interpenetrated metal organic frameworks (MOFs)","Journal of Materials Chemistry","2011","21","44","17737","","10.1039/c1jm13762j","","","0.71073","MoKα","","0.0437","0.0335","","","0.1087","0.1108","","","","","","1.11","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206782","15.524","0.007","11.032","0.004","15.224","0.007","90","","111.847","0.004","90","","2420","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 B F4 N2 O6 -","- C26 H23 B F4 N2 O5 -","- C104 H92 B4 F16 N8 O20 -","4","1","","Sun, Jian-Ke; Jin, Xu-Hui; Cai, Li-Xuan; Zhang, Jie","Supramolecular isomer-dependent photochromism and emission color tuning of bipyridinium salts","Journal of Materials Chemistry","2011","21","44","17667","","10.1039/c1jm13791c","","","0.71073","MoKα","","0.1056","0.0607","","","0.1166","0.1262","","","","","","1.021","","","","has coordinates,has disorder","180398","2020-10-21","18:00:00",""
"7206783","17.481","0.007","12.437","0.005","12.329","0.005","90","","92.152","0.007","90","","2678.6","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 B F4 N2 O7 -","- C26 H27 B F4 N2 O7 -","- C104 H108 B4 F16 N8 O28 -","4","1","","Sun, Jian-Ke; Jin, Xu-Hui; Cai, Li-Xuan; Zhang, Jie","Supramolecular isomer-dependent photochromism and emission color tuning of bipyridinium salts","Journal of Materials Chemistry","2011","21","44","17667","","10.1039/c1jm13791c","","","0.71073","MoKα","","0.0757","0.0576","","","0.0954","0.1027","","","","","","1","","","","has coordinates,has disorder","180398","2020-10-21","18:00:00",""
"7206784","11.7534","0.0016","5.5051","0.0008","12.7118","0.0018","90","","103.726","0.001","90","","799","0.2","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H12 S3 -","- C20 H12 S3 -","- C40 H24 S6 -","2","1","","Shi, Jianwu; Li, Yabo; Jia, Ming; Xu, Li; Wang, Hua","Organic semiconductors based on annelated β-oligothiophenes and its application for organic field-effect transistors","Journal of Materials Chemistry","2011","21","44","17612","","10.1039/c1jm14383b","","","0.71073","MoKα","","0.0238","0.0224","","","0.0619","0.0633","","","","","","1.019","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206785","7.5473","0.0019","5.8673","0.0015","21.88","0.006","90","","95.38","0.004","90","","964.6","0.4","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H16 S3 -","- C24 H16 S3 -","- C48 H32 S6 -","2","1","","Shi, Jianwu; Li, Yabo; Jia, Ming; Xu, Li; Wang, Hua","Organic semiconductors based on annelated β-oligothiophenes and its application for organic field-effect transistors","Journal of Materials Chemistry","2011","21","44","17612","","10.1039/c1jm14383b","","","0.71073","MoKα","","0.0479","0.0445","","","0.1133","0.1156","","","","","","1.05","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206885","13.698","0.005","16.631","0.005","14.562","0.005","90","0.005","95.825","0.005","90","0.005","3300.3","1.9","150","","150","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C53 H28 Cu2 O10 -","- C26.5 H14 Cu O5 -","- C106 H56 Cu4 O20 -","4","1","","Moreau, Florian; Audebrand, Nathalie; Poriel, Cyril; Moizan-Baslé, Virginie; Ouvry, Jean","A 9,9′-spirobifluorene based Metal‒Organic Framework: synthesis, structure analysis and gas sorption properties","Journal of Materials Chemistry","2011","21","46","18715","","10.1039/c1jm12859k","","","0.71069","MoKα","","0.0789","0.049","","","0.1395","0.1504","","","","","","0.958","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206886","6.77318","0.00008","6.77318","","10.00456","0.0002","90","","90","","120","","397.479","0.009","","","","","","","","","","","","4","P -6 c 2","P -6c 2","188","","","","- Ba Hf O9 Si3 -","- Ba Hf O9 Si3 -","- Ba2 Hf2 O18 Si6 -","2","0.166667","","Wang, De-Yin; Wu, Yun-Chen; Chen, Teng-Ming","Synthesis, crystal structure, and photoluminescence of a novel blue-green emitting phosphor: BaHfSi3O9:Eu2+","Journal of Materials Chemistry","2011","21","45","18261","","10.1039/c1jm13438h","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.08928","","2.12","","","","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206887","7.554","0.0009","6.4305","0.001","8.6265","0.0011","90","","107.468","0.014","90","","399.72","0.1","123","2","123","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C7 H11 N3 O -","- C7 H11 N3 O -","- C14 H22 N6 O2 -","2","0.5","","Janikowski, Judith; Forsyth, Craig; MacFarlane, Douglas R.; Pringle, Jennifer M.","Novel ionic liquids and plastic crystals utilizing the cyanate anion","Journal of Materials Chemistry","2011","21","48","19219","","10.1039/c1jm14055h","","","0.71073","MoKα","","0.0644","0.0527","","","0.1453","0.1536","","","","","","1.163","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206888","10.844","0.005","10.972","0.005","15.617","0.005","85.742","0.005","82.695","0.005","82.424","0.005","1823.8","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H32 Ni O8.25 P S4 -","- C36 H32 Ni O8.25 P S4 -","- C72 H64 Ni2 O16.5 P2 S8 -","2","1","","Begum, Ameerunisha; Sonkar, Sumit Kumar; Saxena, Manav; Sarkar, Sabyasachi","Nanocomposites of carbon quantum dots‒nickel(ii) dithiolene as nanolights","Journal of Materials Chemistry","2011","21","48","19210","","10.1039/c1jm14073f","","","0.71069","MoKα","","0.2066","0.0999","","","0.2311","0.3109","","","","","","0.939","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206889","10.297","0.001","10.716","0.002","13.955","0.002","72.22","0.01","70.45","0.01","74.13","0.01","1356.3","0.4","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H34 F6 Fe N4 O4 P -","- C24 H34 F6 Fe N4 O4 P -","- C48 H68 F12 Fe2 N8 O8 P2 -","2","1","","Tissot, Antoine; Bertoni, Roman; Collet, Eric; Toupet, Loic; Boillot, Marie-Laure","The cooperative spin-state transition of an iron(iii) compound [FeIII(3-MeO-SalEen)2]PF6: thermal- vs. ultra-fast photo-switching","Journal of Materials Chemistry","2011","21","45","18347","","10.1039/c1jm14163e","","","0.71073","MoKα","","0.0925","0.0384","","","0.0679","0.077","","","","","","0.781","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206890","10.314","0.001","10.8755","0.0008","14.027","0.001","74.896","0.006","69.384","0.008","75.921","0.007","1401.6","0.2","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H34 F6 Fe N4 O4 P -","- C24 H34 F6 Fe N4 O4 P -","- C48 H68 F12 Fe2 N8 O8 P2 -","2","1","","Tissot, Antoine; Bertoni, Roman; Collet, Eric; Toupet, Loic; Boillot, Marie-Laure","The cooperative spin-state transition of an iron(iii) compound [FeIII(3-MeO-SalEen)2]PF6: thermal- vs. ultra-fast photo-switching","Journal of Materials Chemistry","2011","21","45","18347","","10.1039/c1jm14163e","","","0.71073","MoKα","","0.1168","0.0414","","","0.0834","0.0941","","","","","","0.722","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206891","10.485","0.001","11.015","0.009","14.28","0.01","74.61","0.09","69.29","0.09","75.29","0.07","1463.7","1.9","300","2","300","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H34 F6 Fe N4 O4 P -","- C24 H34 F6 Fe N4 O4 P -","- C48 H68 F12 Fe2 N8 O8 P2 -","2","1","","Tissot, Antoine; Bertoni, Roman; Collet, Eric; Toupet, Loic; Boillot, Marie-Laure","The cooperative spin-state transition of an iron(iii) compound [FeIII(3-MeO-SalEen)2]PF6: thermal- vs. ultra-fast photo-switching","Journal of Materials Chemistry","2011","21","45","18347","","10.1039/c1jm14163e","","","0.71073","MoKα","","0.3536","0.062","","","0.0576","0.0802","","","","","","0.674","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206892","6.8155","0.0014","11.734","0.002","11.551","0.002","90","","103.23","0.03","90","","899.3","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C9 H8 N2 O4 -","- C9 H7 N2 O4 -","- C36 H28 N8 O16 -","4","1","","Yong, Guo-Ping; Zhang, Yi-Man; She, Wen-Long; Li, Ying-Zhou","Stacking-induced white-light and blue-light phosphorescence from purely organic radical materials","Journal of Materials Chemistry","2011","21","46","18520","","10.1039/c1jm14690d","","","0.71073","MoKα","","0.1529","0.0923","","","0.233","0.2717","","","","","","1.069","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7207281","13.9868","0.0009","14.1476","0.0007","15.63","0.001","64.206","0.006","69.087","0.006","84.192","0.005","2595.9","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H65 B2 N O -","- C58 H65 B2 N O -","- C116 H130 B4 N2 O2 -","2","1","","Lin, Ming-Shiang; Chi, Liang-Chen; Chang, Hong-Wei; Huang, Yi-Hsiang; Tien, Kun-Cheng; Chen, Chung-Chia; Chang, Chih-Hao; Wu, Chung-Chih; Chaskar, Atul; Chou, Shu-Hua; Ting, Hao-Chun; Wong, Ken-Tsung; Liu, Yi-Hong; Chi, Yun","A diarylborane-substituted carbazole as a universal bipolar host material for highly efficient electrophosphorescence devices","Journal of Materials Chemistry","2012","22","3","870","","10.1039/c1jm13323c","","","1.54178","CuKα","","0.0955","0.07","","","0.1948","0.2404","","","","","","1.053","","","","has coordinates,has disorder","180403","2020-10-21","18:00:00",""
"7207282","10.828","0.002","20.059","0.006","14.318","0.004","90","","90","","90","","3109.9","1.4","193","2","193","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C6 H10 Cl5 N4 Sb -","- C6 H10 Cl5 N4 Sb -","- C48 H80 Cl40 N32 Sb8 -","8","1","","Piecha, Anna; Białońska, Agata; Jakubas, Ryszard","Novel organic‒inorganic hybrid ferroelectric: bis(imidazolium) pentachloroantimonate(iii), (C3N2H5)2SbCl5","Journal of Materials Chemistry","2012","22","2","333","","10.1039/c1jm13597j","","","0.71073","MoKα","","0.0392","0.0288","","","0.0666","0.0722","","","","","","1.114","","","","has coordinates,has disorder","180403","2020-10-21","18:00:00",""
"7207283","14.211","0.002","19.93","0.003","10.786","0.002","90","","90","","90","","3054.9","0.8","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C6 H10 Cl5 N4 Sb -","- C6 H10 Cl5 N4 Sb -","- C48 H80 Cl40 N32 Sb8 -","8","2","","Piecha, Anna; Białońska, Agata; Jakubas, Ryszard","Novel organic‒inorganic hybrid ferroelectric: bis(imidazolium) pentachloroantimonate(iii), (C3N2H5)2SbCl5","Journal of Materials Chemistry","2012","22","2","333","","10.1039/c1jm13597j","","","0.71073","MoKα","","0.0226","0.0194","","","0.0455","0.0469","","","","","","1.065","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207284","9.91022","0.00013","9.91022","0.00013","7.32094","0.00014","90","","90","","120","","622.679","0.017","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ge6 La7.93 O26 Sr2 -","- Ge6 La7.9312 O26 Sr2 -","- Ge6 La7.9312 O26 Sr2 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.424","","","","","","","has coordinates","288312","2023-12-14","15:05:57",""
"7207285","9.90847","0.00018","9.90847","0.00018","7.32192","0.00016","90","","90","","120","","622.54","0.02","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ge5.84 La7.93 O26 Sr2 V0.16 -","- Ge5.8446 La7.9308 O26 Sr2 V0.1554 -","- Ge5.8446 La7.9308 O26 Sr2 V0.1554 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.388","","","","","","","has coordinates","288312","2023-12-14","15:06:16",""
"7207286","9.90941","0.00013","9.90941","0.00013","7.32414","0.00015","90","","90","","120","","622.849","0.017","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ge5.58 La7.99 O26 Sr2 V0.42 -","- Ge5.5848 La7.9884 O26 Sr2.0004 V0.4152 -","- Ge5.5848 La7.9884 O26 Sr2.0004 V0.4152 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.44","","","","","","","has coordinates","288312","2023-12-14","15:06:29",""
"7207287","9.87089","0.00015","9.87089","0.00015","7.22428","0.00017","90","","90","","120","","609.59","0.019","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ca2 Ge6 La7.8 O26 -","- Ca1.998 Ge6 La7.794 O26 -","- Ca1.998 Ge6 La7.794 O26 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.526","","","","","","","has coordinates","288312","2023-12-14","15:06:35",""
"7207288","9.86956","0.00014","9.86956","0.00014","7.22553","0.00016","90","","90","","120","","609.531","0.018","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ca2 Ge5.62 La7.82 O26 V0.38 -","- Ca1.998 Ge5.6214 La7.83 O26 V0.3786 -","- Ca1.998 Ge5.6214 La7.83 O26 V0.3786 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.489","","","","","","","has coordinates","288312","2023-12-14","15:06:43",""
"7207289","9.87087","0.00016","9.87087","0.00016","7.22604","0.00019","90","","90","","120","","609.74","0.02","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ca2 Ge5.35 La7.88 O26 V0.65 -","- Ca1.998 Ge5.3454 La7.874 O26 V0.6546 -","- Ca1.998 Ge5.3454 La7.874 O26 V0.6546 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.416","","","","","","","has coordinates","288312","2023-12-14","15:07:52",""
"7207290","9.97963","0.00016","9.97963","0.00016","7.41046","0.00017","90","","90","","120","","639.15","0.02","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ba2 Ge6 La7.88 O26 -","- Ba2.004 Ge6 La7.876 O26 -","- Ba2.004 Ge6 La7.876 O26 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.478","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207291","9.97623","0.00015","9.97623","0.00015","7.41273","0.00016","90","","90","","120","","638.913","0.019","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ba2 Ge5.66 La7.88 O26 V0.34 -","- Ba2.004 Ge5.6628 La7.884 O26 V0.3372 -","- Ba2.004 Ge5.6628 La7.884 O26 V0.3372 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.444","","","","","","","has coordinates","190010","2020-10-21","18:00:00",""
"7207292","9.97861","0.00017","9.97861","0.00017","7.41128","0.00018","90","","90","","120","","639.09","0.02","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ba2 Ge5.29 La7.67 O26 V0.71 -","- Ba1.996 Ge5.292 La7.668 O26 V0.708 -","- Ba1.996 Ge5.292 La7.668 O26 V0.708 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.518","","","","","","","has coordinates","190010","2020-10-21","18:00:00",""
"7207293","9.589","0.003","13.452","0.004","14.158","0.004","106.847","0.003","91.096","0.005","100.771","0.004","1711.9","0.9","93","","93","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H34 N4 O4 -","- C44 H34 N4 O4 -","- C88 H68 N8 O8 -","2","1","","Tabata, Hideyuki; Tokoyama, Hiroaki; Yamakado, Hideo; Okuno, Tsunehisa","Preparation and properties of two-legged ladder polymers based on polydiacetylenes","Journal of Materials Chemistry","2012","22","1","115","","10.1039/c1jm13896k","","","0.71075","MoKα","","","0.0613","","","","0.1771","","","","","","1.004","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207294","12.339","0.003","4.748","0.0009","16.949","0.003","90","","110.06","0.03","90","","932.7","0.4","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Z, Z)-cyclo[2](dibenzo[b,d]thiophen-2, 8-yl-ethylene)","","- C28 H16 S2 -","- C28 H16 S2 -","- C56 H32 S4 -","2","0.5","","Qiao, Yali; Wei, Zhongming; Risko, Chad; Li, Hong; Brédas, Jean-Luc; Xu, Wei; Zhu, Daoben","Synthesis, experimental and theoretical characterization, and field-effect transistor properties of a new class of dibenzothiophene derivatives: From linear to cyclic architectures","Journal of Materials Chemistry","2012","22","4","1313","","10.1039/c1jm13962b","","","0.71073","MoKα","","0.0352","0.0326","","","0.0882","0.0905","","","","","","1.037","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207295","18.924","0.004","6.2925","0.0013","7.9164","0.0016","90","","99.48","0.03","90","","929.8","0.3","173","2","173","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Z)-1, 2-bis(dibenzo[b,d]thiophen-2-yl)ethene","","- C26 H16 S2 -","- C26 H16 S2 -","- C52 H32 S4 -","2","0.5","","Qiao, Yali; Wei, Zhongming; Risko, Chad; Li, Hong; Brédas, Jean-Luc; Xu, Wei; Zhu, Daoben","Synthesis, experimental and theoretical characterization, and field-effect transistor properties of a new class of dibenzothiophene derivatives: From linear to cyclic architectures","Journal of Materials Chemistry","2012","22","4","1313","","10.1039/c1jm13962b","","","0.71073","MoKα","","0.0879","0.0706","","","0.1345","0.1423","","","","","","1.159","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207296","6.792","0.0015","10.677","0.002","12.729","0.003","90","","97.719","0.004","90","","914.7","0.3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-1, 2-bis(dibenzo[b,d]thiophen-2-yl)ethene","","- C26 H16 S2 -","- C26 H16 S2 -","- C52 H32 S4 -","2","0.5","","Qiao, Yali; Wei, Zhongming; Risko, Chad; Li, Hong; Brédas, Jean-Luc; Xu, Wei; Zhu, Daoben","Synthesis, experimental and theoretical characterization, and field-effect transistor properties of a new class of dibenzothiophene derivatives: From linear to cyclic architectures","Journal of Materials Chemistry","2012","22","4","1313","","10.1039/c1jm13962b","","","0.71073","MoKα","","0.066","0.0617","","","0.1154","0.1176","","","","","","1.234","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207297","7.129","0.003","13.514","0.005","6.915","0.003","90","","91.715","0.005","90","","665.9","0.5","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-nitro-5-methoxy-1,2,4-oxadiazole","","- C4 H7 N5 O2 -","- C4 H7 N5 O2 -","- C16 H28 N20 O8 -","4","1","","Fu, Zhanda; He, Cheng; Chen, Fu-xue","Synthesis and characteristics of a novel, high-nitrogen, heat-resistant, insensitive material (NOG2Tz)","Journal of Materials Chemistry","2012","22","1","60","","10.1039/c1jm14232a","","","0.71073","MoKα","","0.0784","0.0492","","","0.1355","0.147","","","","","","1.002","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207298","5.75","0.002","8.875","0.003","15.739","0.006","80.614","0.011","80.732","0.01","81.456","0.01","775.9","0.5","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","3,6-di(3-nitro-1,2,4-oxadiazole)-di(3-nitro-1,2,4-oxadiazole)-1,2,4,5-tetrazine","","- C16 H30 N16 O10 S4 -","- C16 H30 N16 O10 S4 -","- C16 H30 N16 O10 S4 -","1","0.5","","Fu, Zhanda; He, Cheng; Chen, Fu-xue","Synthesis and characteristics of a novel, high-nitrogen, heat-resistant, insensitive material (NOG2Tz)","Journal of Materials Chemistry","2012","22","1","60","","10.1039/c1jm14232a","","","0.71073","MoKα","","0.0858","0.0511","","","0.1117","0.1271","","","","","","1.002","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7207299","7.736","0.007","9.684","0.009","12.512","0.011","100.163","0.015","98.071","0.011","100.744","0.009","891.8","1.4","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 H7 N9 O2 -","- C4 H7 N9 O2 -","- C16 H28 N36 O8 -","4","2","","Lin, Qiu-Han; Li, Yu-Chuan; Li, Ya-Yu; Wang, Zhu; Liu, Wei; Qi, Cai; Pang, Si-Ping","Energetic salts based on 1-amino-1,2,3-triazole and 3-methyl-1-amino-1,2,3-triazole","Journal of Materials Chemistry","2012","22","2","666","","10.1039/c1jm14322k","","","0.71073","MoKα","","0.0765","0.0472","","","0.0995","0.1054","","","","","","0.999","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207300","5.681","0.0016","7.222","0.002","19.096","0.006","90","","97.778","0.004","90","","776.3","0.4","133","2","133","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H14 N18 -","- C8 H14 N18 -","- C16 H28 N36 -","2","0.5","","Lin, Qiu-Han; Li, Yu-Chuan; Li, Ya-Yu; Wang, Zhu; Liu, Wei; Qi, Cai; Pang, Si-Ping","Energetic salts based on 1-amino-1,2,3-triazole and 3-methyl-1-amino-1,2,3-triazole","Journal of Materials Chemistry","2012","22","2","666","","10.1039/c1jm14322k","","","0.71073","MoKα","","0.045","0.0353","","","0.0884","0.0935","","","","","","1.002","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207301","15.592","0.004","10.246","0.002","9.813","0.002","90","","90.405","0.004","90","","1567.6","0.6","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H5 N9 O2 -","- C3 H5 N9 O2 -","- C24 H40 N72 O16 -","8","2","","Lin, Qiu-Han; Li, Yu-Chuan; Li, Ya-Yu; Wang, Zhu; Liu, Wei; Qi, Cai; Pang, Si-Ping","Energetic salts based on 1-amino-1,2,3-triazole and 3-methyl-1-amino-1,2,3-triazole","Journal of Materials Chemistry","2012","22","2","666","","10.1039/c1jm14322k","","","0.71073","MoKα","","0.0636","0.0533","","","0.1291","0.1374","","","","","","0.998","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7207302","15.4598","0.0016","10.805","0.0011","9.9452","0.0011","90","","90","","90","","1661.3","0.3","296","2","296","2","","","","","","","","3","A b a 2","A 2 -2ab","41","","","","- B2 O7 Pb4 -","- B2 O7 Pb4 -","- B16 O56 Pb32 -","8","","","Yu, Hongwei; Pan, Shilie; Wu, Hongping; Zhao, Wenwu; Zhang, Fangfang; Li, Hongyi; Yang, Zhihua","A new congruent-melting oxyborate, Pb4O(BO3)2 with optimally aligned BO3 triangles adopting layered-type arrangement","Journal of Materials Chemistry","2012","22","5","2105","","10.1039/c1jm14590h","","","0.71073","MoKα","","0.0329","0.0301","","","0.0695","0.0712","","","","","","1.064","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207303","10.773","0.004","10.773","0.004","13.947","0.005","90","","90","","90","","1618.7","1","108","2","108","2","","","","","","","","5","P 4/m m m","-P 4 2","123","","","","- C19 H20 N O8 Zn -","- C13 N O4 Zn -","- C26 N2 O8 Zn2 -","2","0.125","","Henke, Sebastian; Schneemann, Andreas; Kapoor, Shobhna; Winter, Roland; Fischer, Roland A.","Zinc-1,4-benzenedicarboxylate-bipyridine frameworks ‒ linker functionalization impacts network topology during solvothermal synthesis","Journal of Materials Chemistry","2012","22","3","909","","10.1039/c1jm14791a","","","0.71073","MoKα","","0.0873","0.0348","","","0.052","0.0663","","","","","","0.658","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207304","11.78","0.02","18.24","0.03","8.28","0.007","90","","123.97","0.1","90","","1475","4","106.7","","106.7","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C15 H12 N O6 Zn -","- C15 H12 N O6 Zn -","- C60 H48 N4 O24 Zn4 -","4","0.5","","Henke, Sebastian; Schneemann, Andreas; Kapoor, Shobhna; Winter, Roland; Fischer, Roland A.","Zinc-1,4-benzenedicarboxylate-bipyridine frameworks ‒ linker functionalization impacts network topology during solvothermal synthesis","Journal of Materials Chemistry","2012","22","3","909","","10.1039/c1jm14791a","","","0.71073","MoKα","","0.1803","0.0906","","","0.1535","0.1903","","","","","","1.029","","","","has coordinates,has disorder","180404","2020-10-21","18:00:00",""
"7207305","6.737","0.002","8.541","0.003","8.965","0.003","79.742","0.007","68.025","0.007","67.714","0.007","442.2","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H16 N2 -","- C24 H16 N2 -","- C24 H16 N2 -","1","0.5","","Xu, Yuanxiang; Zhang, Houyu; Li, Feng; Shen, Fangzhong; Wang, Huan; Li, Xianjie; Yu, Yang; Ma, Yuguang","Supramolecular interaction-induced self-assembly of organic molecules into ultra-long tubular crystals with wave guiding and amplified spontaneous emission","Journal of Materials Chemistry","2012","22","4","1592","","10.1039/c1jm14815j","","","0.71073","MoKα","","0.1464","0.0563","","","0.1176","0.1574","","","","","","0.946","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207306","8.2215","0.0005","18.0008","0.0011","17.3401","0.0011","90","","100.406","0.001","90","","2524","0.3","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H24 N2 -","- C36 H24 N2 -","- C144 H96 N8 -","4","1","","Gong, Shaolong; He, Xun; Chen, Yonghua; Jiang, Zuoquan; Zhong, Cheng; Ma, Dongge; Qin, Jingui; Yang, Chuluo","Simple CBP isomers with high triplet energies for highly efficient blue electrophosphorescence","Journal of Materials Chemistry","2012","22","7","2894","","10.1039/c1jm14903b","","","0.71073","MoKα","","0.0941","0.0536","","","0.1088","0.122","","","","","","0.939","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207307","8.942","0.0018","13.149","0.003","14.67","0.003","68.23","0.03","84.59","0.03","75.23","0.03","1548.9","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H35 N4 O4 -","- C35 H35 N4 O4 -","- C70 H70 N8 O8 -","2","1","","Liu, Yunlong; Lv, Xin; Zhao, Yun; Liu, Jing; Sun, Yuan-Qiang; Wang, Pi; Guo, Wei","A Cu(ii)-based chemosensing ensemble bearing rhodamine B fluorophore for fluorescence turn-on detection of cyanide","Journal of Materials Chemistry","2012","22","5","1747","","10.1039/c1jm15072c","","","0.71073","MoKα","","0.1226","0.0666","","","0.1276","0.1534","","","","","","1.024","","","","has coordinates,has disorder","180404","2020-10-21","18:00:00",""
"7207308","12.2737","0.0019","24.368","0.004","12.778","0.0019","90","","99.816","0.002","90","","3765.8","1","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C78 H80 Cl4 Cu4 N12 O8 -","- C78 H80 Cl4 Cu4 N12 O8 -","- C156 H160 Cl8 Cu8 N24 O16 -","2","0.5","","Liu, Yunlong; Lv, Xin; Zhao, Yun; Liu, Jing; Sun, Yuan-Qiang; Wang, Pi; Guo, Wei","A Cu(ii)-based chemosensing ensemble bearing rhodamine B fluorophore for fluorescence turn-on detection of cyanide","Journal of Materials Chemistry","2012","22","5","1747","","10.1039/c1jm15072c","","","0.71073","MoKα","","0.081","0.0583","","","0.148","0.1613","","","","","","1.296","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207313","19.033","0.005","14.272","0.004","26.672","0.007","90","","94.787","0.004","90","","7220","3","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C37 H26 Cl2 F6 Ir N4 O2 P -","- C37 H26 Cl2 F6 Ir N4 O2 P -","- C296 H208 Cl16 F48 Ir8 N32 O16 P8 -","8","1","","Cao, Xinhua; Wu, Yongquan; Liu, Keyin; Yu, Xudong; Wu, Bo; Wu, Huazhou; Gong, Zuguang; Yi, Tao","Iridium complex triggered white-light-emitting gel and its response to cysteine","Journal of Materials Chemistry","2012","22","6","2650","","10.1039/c2jm13826c","","","0.71073","MoKα","","0.0628","0.0447","","","0.1255","0.1353","","","","","","1.076","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207314","15.07392","","15.07392","","15.07392","","90","","90","","90","","3425.14","","293","","293","","","","","","","","","4","P a -3","-P 2ac 2ab","205","","","","- Ca3 N2 O4 Si2 -","- Ca3 N2 O4 Si2 -","- Ca72 N48 O96 Si48 -","24","1","","Wang, Xiao-Ming; Wang, Chun-Hai; Wu, M. M.; Wang, Y. X.; Jing, Xi-Ping","O/N ordering in the structure of Ca3Si2O4N2 and the luminescence properties of the Ce3+ doped material","Journal of Materials Chemistry","2012","22","8","3388","","10.1039/c2jm13852b","powder diffraction","","1.5406","CuKα","","","","","","","","","","","","","","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207315","10.4133","0.0006","10.899","0.0005","13.074","0.0006","77.607","0.004","77.442","0.004","86.648","0.004","1414.47","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H19 La2 N3 O17 -","- C21 H17 La2 N3 O17 -","- C42 H34 La4 N6 O34 -","2","1","","Rao, Xingtang; Huang, Qian; Yang, Xiuli; Cui, Yuanjing; Yang, Yu; Wu, Chuande; Chen, Banglin; Qian, Guodong","Color tunable and white light emitting Tb3+ and Eu3+ doped lanthanide metal‒organic framework materials","Journal of Materials Chemistry","2012","22","7","3210","","10.1039/c2jm14127b","","","0.71073","MoKα","","0.0764","0.0454","","","0.0975","0.1149","","","","","","1.124","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207316","9.808","0.002","11.209","0.002","12.043","0.002","79.92","0.03","87.34","0.03","65.46","0.03","1185.3","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H16 Cl3 N2 O4 Re -","- C23 H16 Cl3 N2 O4 Re -","- C46 H32 Cl6 N4 O8 Re2 -","2","1","","Liu, Xiaoming; Xia, Hong; Gao, Wei; Wu, Qiaolin; Fan, Xiao; Mu, Ying; Ma, Chunsheng","New rhenium(i) complexes with substituted diimine ligands for highly efficient phosphorescent devices fabricated by a solution process","Journal of Materials Chemistry","2012","22","8","3485","","10.1039/c2jm14222h","","","0.71073","MoKα","","0.036","0.0344","","","0.0927","0.0934","","","","","","1.088","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207317","21.756","0.004","11.09","0.002","11.085","0.002","90","","119.155","0.002","90","","2335.7","0.7","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C44 H52 Mn2 N8 O12 -","- C44 H52 Mn2 N8 O12 -","- C88 H104 Mn4 N16 O24 -","2","0.5","","Yang, Peng; He, Xiang; Li, Ming-Xing; Ye, Qiong; Ge, Jia-Zhen; Wang, Zhao-Xi; Zhu, Shou-Rong; Shao, Min; Cai, Hong-Ling","The first homochiral coordination polymer with temperature-independent piezoelectric and dielectric properties","Journal of Materials Chemistry","2012","22","6","2398","","10.1039/c2jm14961c","","","0.71073","MoKα","","0.0264","0.0246","","","0.0621","0.0632","","","","","","1.045","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207318","7.521","0.012","17.21","0.03","19.15","0.03","90","","95.26","0.02","90","","2468","7","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H64 Co2 N12 O16 -","- C44 H58 Co2 N12 O16 -","- C88 H116 Co4 N24 O32 -","2","1","","Yang, Peng; He, Xiang; Li, Ming-Xing; Ye, Qiong; Ge, Jia-Zhen; Wang, Zhao-Xi; Zhu, Shou-Rong; Shao, Min; Cai, Hong-Ling","The first homochiral coordination polymer with temperature-independent piezoelectric and dielectric properties","Journal of Materials Chemistry","2012","22","6","2398","","10.1039/c2jm14961c","","","0.71073","MoKα","","0.1661","0.0738","","","0.1243","0.1502","","","","","","1.035","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207319","9.0582","0.0001","9.0582","0.0001","12.566","0.0002","90","","90","","90","","1031.05","0.02","298","2","298","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C4 H12 Cu N6 O6 -","- C4 H12 Cu N6 O6 -","- C16 H48 Cu4 N24 O24 -","4","0.5","","Spencer, Elinor C.; Ross, Nancy L.; Angel, Ross J.","The high pressure behaviour of the 3D copper carbonate framework {[Cu(CO3)2](CH6N3)2}n","Journal of Materials Chemistry","2012","22","5","2074","","10.1039/c2jm15206a","","","0.71073","MoKα","","0.0342","0.033","","","0.0973","0.098","","","","","","1.16","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207320","8.9664","0.0003","8.9664","0.0003","12.3548","0.0003","90","","90","","90","","993.28","0.05","298","2","298","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C4 H12 Cu N6 O6 -","- C4 H12 Cu N6 O6 -","- C16 H48 Cu4 N24 O24 -","4","0.5","","Spencer, Elinor C.; Ross, Nancy L.; Angel, Ross J.","The high pressure behaviour of the 3D copper carbonate framework {[Cu(CO3)2](CH6N3)2}n","Journal of Materials Chemistry","2012","22","5","2074","","10.1039/c2jm15206a","","x-ray","0.71073","MoKα","","0.0714","0.0569","","","0.1386","0.1498","","","","","","1.099","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207321","8.8645","0.0003","8.8645","0.0003","12.1191","0.0003","90","","90","","90","","952.31","0.05","298","2","298","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C4 H12 Cu N6 O6 -","- C4 H12 Cu N6 O6 -","- C16 H48 Cu4 N24 O24 -","4","0.5","","Spencer, Elinor C.; Ross, Nancy L.; Angel, Ross J.","The high pressure behaviour of the 3D copper carbonate framework {[Cu(CO3)2](CH6N3)2}n","Journal of Materials Chemistry","2012","22","5","2074","","10.1039/c2jm15206a","","x-ray","0.71073","MoKα","","0.0893","0.0742","","","0.1945","0.2061","","","","","","1.385","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207322","8.8048","0.0002","8.8048","0.0002","12.031","0.0002","90","","90","","90","","932.7","0.03","298","2","298","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C4 H12 Cu N6 O6 -","- C4 H12 Cu N6 O6 -","- C16 H48 Cu4 N24 O24 -","4","0.5","","Spencer, Elinor C.; Ross, Nancy L.; Angel, Ross J.","The high pressure behaviour of the 3D copper carbonate framework {[Cu(CO3)2](CH6N3)2}n","Journal of Materials Chemistry","2012","22","5","2074","","10.1039/c2jm15206a","","x-ray","0.71073","MoKα","","0.1045","0.0884","","","0.2416","0.2658","","","","","","1.145","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207323","12.363","0.013","5.876","0.005","15.136","0.016","90","","90.31","0.08","90","","1099.5","1.9","113","2","113","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Bis(2,2-dinitroethyl)nitramine","","","- C4 H6 N6 O10 -","- C4 H6 N6 O10 -","- C16 H24 N24 O40 -","4","0.5","","Song, Jinhong; Zhou, Zhiming; Dong, Xiao; Huang, Haifeng; Cao, Dan; Liang, Lixuan; Wang, Kai; Zhang, Jun; Chen, Fu-xue; Wu, Yukai","Super-high-energy materials based on bis(2,2-dinitroethyl)nitramine","Journal of Materials Chemistry","2012","22","7","3201","","10.1039/c2jm15310f","","","0.71073","MoKα","","0.0622","0.0507","","","0.0967","0.0995","","","","","","1.08","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207369","30.7917","0.0004","10.2374","0.0001","11.7082","0.0002","90","","90.481","0.001","90","","3690.61","0.09","133","2","133","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44 H40 N4 Si -","- C44 H40 N4 Si -","- C176 H160 N16 Si4 -","4","0.5","","Mei, J.; Wang, J.; Qin, A.; Zhao, H.; Yuan, W.; Zhao, Z.; Sung, H. H. Y.; Deng, C.; Zhang, S.; Williams, I. D.; Sun, J. Z.; Tang, B. Z.","Construction of soft porous crystal with silole derivative: strategy of framework design, multiple structural transformability and mechanofluorochromism","Journal of Materials Chemistry","2012","22","10","4290","","10.1039/c1jm12673c","","","1.54178","CuKα","","0.0396","0.0366","","","0.1015","0.1043","","","","","","1.036","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207370","13.268","0.003","10.287","0.002","13.771","0.004","90","","113.39","0.03","90","","1725.1","0.8","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H32 N4 O Si -","- C41 H32 N4 O Si -","- C82 H64 N8 O2 Si2 -","2","0.5","","Mei, J.; Wang, J.; Qin, A.; Zhao, H.; Yuan, W.; Zhao, Z.; Sung, H. H. Y.; Deng, C.; Zhang, S.; Williams, I. D.; Sun, J. Z.; Tang, B. Z.","Construction of soft porous crystal with silole derivative: strategy of framework design, multiple structural transformability and mechanofluorochromism","Journal of Materials Chemistry","2012","22","10","4290","","10.1039/c1jm12673c","","","1.54178","CuKα","","0.095","0.0562","","","0.1091","0.1175","","","","","","1.003","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207371","17.8066","0.0007","8.6123","0.0004","16.768","0.0007","90","","93.194","0.004","90","","2567.48","0.19","295","1","295","1","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 N2 O2 -","- C30 H34 N2 O2 -","- C120 H136 N8 O8 -","4","1","","Kanth Siram, Raja Bhaskar; Smith, Jeremy; Anthopoulos, Thomas D.; Patil, Satish","Acenaphtho[1,2-b]quinoxaline based low band gap copolymers for organic thin film transistor applications","Journal of Materials Chemistry","2012","22","10","4450","","10.1039/c1jm13540f","","x-ray","0.71073","MoKα","","0.1026","0.0546","","","0.1356","0.1551","","","","","","1.086","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207372","26.232","0.005","10","0.002","15.213","0.003","90","","100.53","0.03","90","","3923.5","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H18 B N O2 -","- C25 H18 B N O2 -","- C200 H144 B8 N8 O16 -","8","1","","Li, Di; Zhang, Hongyu; Wang, Chenguang; Huang, Shuo; Guo, Jianhua; Wang, Yue","Construction of full-color-tunable and strongly emissive materials by functionalizing a boron-chelate four-ring-fused π-conjugated core","Journal of Materials Chemistry","2012","22","10","4319","","10.1039/c1jm14606h","","","0.71073","MoKα","","0.1743","0.0742","","","0.1247","0.154","","","","","","0.997","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207373","9.781","0.002","13.651","0.003","16.457","0.005","90","","114.07","0.02","90","","2006.3","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H18 B N O S -","- C25 H18 B N O S -","- C100 H72 B4 N4 O4 S4 -","4","1","","Li, Di; Zhang, Hongyu; Wang, Chenguang; Huang, Shuo; Guo, Jianhua; Wang, Yue","Construction of full-color-tunable and strongly emissive materials by functionalizing a boron-chelate four-ring-fused π-conjugated core","Journal of Materials Chemistry","2012","22","10","4319","","10.1039/c1jm14606h","","","0.71073","MoKα","","0.1106","0.0542","","","0.1284","0.1502","","","","","","1.043","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207374","13.017","0.003","12.93","0.003","18.193","0.006","90","","132.518","0.018","90","","2256.9","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 B N2 O S -","- C27 H23 B N2 O S -","- C108 H92 B4 N8 O4 S4 -","4","1","","Li, Di; Zhang, Hongyu; Wang, Chenguang; Huang, Shuo; Guo, Jianhua; Wang, Yue","Construction of full-color-tunable and strongly emissive materials by functionalizing a boron-chelate four-ring-fused π-conjugated core","Journal of Materials Chemistry","2012","22","10","4319","","10.1039/c1jm14606h","","","0.71073","MoKα","","0.0804","0.0445","","","0.1006","0.1137","","","","","","1.023","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207375","12.881","0.002","9.6559","0.0016","13.088","0.002","90","","110.357","0.003","90","","1526.2","0.4","571","2","571","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 La2 O14 S -","- C8 H12 La2 O14 S -","- C32 H48 La8 O56 S4 -","4","1","","D'Vries, Richard F.; Iglesias, Marta; Snejko, Natalia; Alvarez-Garcia, Susana; Gutiérrez-Puebla, Enrique; Monge, M. Angeles","Mixed lanthanide succinate‒sulfate 3D MOFs: catalysts in nitroaromatic reduction reactions and emitting materials","Journal of Materials Chemistry","2012","22","3","1191","","10.1039/c1jm14677g","","","0.71073","MoKα","","0.0472","0.0344","","","0.0733","0.076","","","","","","1.183","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207376","12.758","0.001","9.5881","0.0008","12.9304","0.0011","90","","110.233","0.001","90","","1484.1","0.2","571","2","571","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 O14 Pr2 S -","- C8 H12 O14 Pr2 S -","- C32 H48 O56 Pr8 S4 -","4","1","","D'Vries, Richard F.; Iglesias, Marta; Snejko, Natalia; Alvarez-Garcia, Susana; Gutiérrez-Puebla, Enrique; Monge, M. Angeles","Mixed lanthanide succinate‒sulfate 3D MOFs: catalysts in nitroaromatic reduction reactions and emitting materials","Journal of Materials Chemistry","2012","22","3","1191","","10.1039/c1jm14677g","","","0.71073","MoKα","","0.0429","0.0356","","","0.0907","0.0925","","","","","","1.376","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207377","12.7225","0.0019","9.5748","0.0014","12.897","0.002","90","","110.205","0.002","90","","1474.4","0.4","571","2","571","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 Nd2 O14 S -","- C8 H12 Nd2 O14 S -","- C32 H48 Nd8 O56 S4 -","4","1","","D'Vries, Richard F.; Iglesias, Marta; Snejko, Natalia; Alvarez-Garcia, Susana; Gutiérrez-Puebla, Enrique; Monge, M. Angeles","Mixed lanthanide succinate‒sulfate 3D MOFs: catalysts in nitroaromatic reduction reactions and emitting materials","Journal of Materials Chemistry","2012","22","3","1191","","10.1039/c1jm14677g","","","0.71073","MoKα","","0.0836","0.0696","","","0.1961","0.2002","","","","","","1.314","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207378","12.6365","0.0006","9.5308","0.0004","12.8091","0.0006","90","","110.128","0.001","90","","1448.46","0.11","571","2","571","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 O14 S Sm2 -","- C8 H12 O14 S Sm2 -","- C32 H48 O56 S4 Sm8 -","4","1","","D'Vries, Richard F.; Iglesias, Marta; Snejko, Natalia; Alvarez-Garcia, Susana; Gutiérrez-Puebla, Enrique; Monge, M. Angeles","Mixed lanthanide succinate‒sulfate 3D MOFs: catalysts in nitroaromatic reduction reactions and emitting materials","Journal of Materials Chemistry","2012","22","3","1191","","10.1039/c1jm14677g","","","0.71073","MoKα","","0.0489","0.0365","","","0.0821","0.085","","","","","","1.272","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207379","5.2396","0.0002","11.2287","0.0004","11.5459","0.0005","94.362","0.003","99.095","0.002","103.466","0.002","647.79","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H8 Br2 F14 N2 O4 -","- C26 H8 Br2 F14 N2 O4 -","- C26 H8 Br2 F14 N2 O4 -","1","0.5","","Usta, Hakan; Kim, Choongik; Wang, Zhiming; Lu, Shaofeng; Huang, Hui; Facchetti, Antonio; Marks, Tobin J.","Anthracenedicarboximide-based semiconductors for air-stable, n-channel organic thin-film transistors: materials design, synthesis, and structural characterization","Journal of Materials Chemistry","2012","22","10","4459","","10.1039/c1jm14713g","","","0.71073","MoKα","","0.0497","0.0334","","","0.0692","0.0732","","","","","","0.967","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207380","5.5811","0.0004","8.4397","0.0007","20.1209","0.0014","90.954","0.006","91.204","0.006","93.579","0.007","945.54","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H24 F14 N4 O4 -","- C42 H24 F14 N4 O4 -","- C42 H24 F14 N4 O4 -","1","0.5","","Usta, Hakan; Kim, Choongik; Wang, Zhiming; Lu, Shaofeng; Huang, Hui; Facchetti, Antonio; Marks, Tobin J.","Anthracenedicarboximide-based semiconductors for air-stable, n-channel organic thin-film transistors: materials design, synthesis, and structural characterization","Journal of Materials Chemistry","2012","22","10","4459","","10.1039/c1jm14713g","","","0.71073","MoKα","","0.3874","0.0799","","","0.127","0.177","","","","","","0.907","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207381","16.759","0.005","4.4914","0.0014","18.515","0.007","90","","114.283","0.005","90","","1270.3","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 Cl2 N2 -","- C30 H34 Cl2 N2 -","- C60 H68 Cl4 N4 -","2","0.5","","Zhao, Guangyao; Dong, Huanli; Zhao, Huaping; Jiang, Lang; Zhang, Xiaotao; Tan, Jiahui; Meng, Qing; Hu, Wenping","Substitution effect on molecular packing and transistor performance of indolo[3,2-b]carbazole derivatives","Journal of Materials Chemistry","2012","22","10","4409","","10.1039/c1jm14891e","","","0.71073","MoKα","","0.0616","0.0558","","","0.1155","0.1185","","","","","","1.193","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207382","13.125","0.003","5.6381","0.0011","8.0541","0.0016","90","","96.23","0.03","90","","592.5","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 N2 -","- C18 H12 N2 -","- C36 H24 N4 -","2","0.5","","Zhao, Guangyao; Dong, Huanli; Zhao, Huaping; Jiang, Lang; Zhang, Xiaotao; Tan, Jiahui; Meng, Qing; Hu, Wenping","Substitution effect on molecular packing and transistor performance of indolo[3,2-b]carbazole derivatives","Journal of Materials Chemistry","2012","22","10","4409","","10.1039/c1jm14891e","","","0.71073","MoKα","","0.0418","0.0365","","","0.0981","0.1023","","","","","","1.075","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207383","14.73","0.003","5.8026","0.0012","7.6541","0.0015","90","","100.39","0.03","90","","643.5","0.2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 Cl2 N2 -","- C18 H10 Cl2 N2 -","- C36 H20 Cl4 N4 -","2","0.5","","Zhao, Guangyao; Dong, Huanli; Zhao, Huaping; Jiang, Lang; Zhang, Xiaotao; Tan, Jiahui; Meng, Qing; Hu, Wenping","Substitution effect on molecular packing and transistor performance of indolo[3,2-b]carbazole derivatives","Journal of Materials Chemistry","2012","22","10","4409","","10.1039/c1jm14891e","","","0.71073","MoKα","","0.0319","0.0293","","","0.0899","0.0912","","","","","","1.121","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207498","8.9605","0.0002","10.9189","0.0003","14.3701","0.0004","68.122","0.001","84.327","0.002","85.734","0.002","1297.23","0.06","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C23 H22 Cl2 N2 O6 S3 -","- C23.003 H22 Cl2.006 N2 O6 S3 -","- C46.006 H44 Cl4.012 N4 O12 S6 -","2","1","","Bolduc, Andréanne; Dufresne, Stéphane; Skene, W. G.","Chemical doping of EDOT azomethine derivatives: insight into the oxidative and hydrolytic stability","Journal of Materials Chemistry","2012","22","11","5053","","10.1039/c2jm14248a","","","1.54178","CuKα","","0.0895","0.0674","","","0.1864","0.2004","","","","","","1.077","","","","has coordinates,has disorder","180405","2020-10-21","18:00:00",""
"7207499","9.9129","0.0008","31.483","0.002","18.6483","0.0014","90","","105.132","0.002","90","","5618.1","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 N2 O S4 -","- C30 H28 N2 O S4 -","- C240 H224 N16 O8 S32 -","8","2","","Chen, Dugang; Zhong, Cheng; Dong, Xiaohu; Liu, Zhihong; Qin, Jingui","A new building block, bis(thiophene vinyl)-pyrimidine, for constructing excellent two-photon absorption materials: synthesis, crystal structure and properties","Journal of Materials Chemistry","2012","22","10","4343","","10.1039/c2jm14766a","","","0.71073","MoKα","","0.1105","0.0734","","","0.181","0.201","","","","","","1.043","","","","has coordinates,has disorder","180405","2020-10-21","18:00:00",""
"7207500","21.295","0.002","16.3989","0.0019","9.7404","0.0011","90","","98.263","0.002","90","","3366.2","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C45 H33 Cl2 N -","- C45 H33 Cl2 N -","- C180 H132 Cl8 N4 -","4","1","","Zhao, Zujin; Chan, Carrie Y. K.; Chen, Shuming; Deng, Chunmei; Lam, Jacky W. Y.; Jim, Cathy K. W.; Hong, Yuning; Lu, Ping; Chang, Zhengfeng; Chen, Xiaopeng; Lu, Ping; Kwok, Hoi Sing; Qiu, Huayu; Tang, Ben Zhong","Using tetraphenylethene and carbazole to create efficient luminophores with aggregation-induced emission, high thermal stability, and good hole-transporting property","Journal of Materials Chemistry","2012","22","10","4527","","10.1039/c2jm14914a","","","0.71073","MoKα","","0.0886","0.0683","","","0.1637","0.1743","","","","","","1.045","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207501","13.0466","0.0003","7.5537","0.0002","23.8222","0.0006","90","","91.002","0.001","90","","2347.32","0.1","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","HB364","","","- C26 H30 N4 S -","- C26 H30 N4 S -","- C104 H120 N16 S4 -","4","1","","Ojala, Antti; Bürckstümmer, Hannah; Hwang, Jaehyung; Graf, Katja; von Vacano, Bernhard; Meerholz, Klaus; Erk, Peter; Würthner, Frank","Planar, bulk and hybrid merocyanine/C60 heterojunction devices: a case study on thin film morphology and photovoltaic performance","Journal of Materials Chemistry","2012","22","10","4473","","10.1039/c2jm14927c","","","1.54178","CuKα","","0.035","0.034","","","0.093","0.094","","","","","","1.033","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207502","6.732","0.01","7.648","0.013","13.372","0.019","90","","94.23","0.06","90","","686.6","1.8","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H6 Cl2 N2 O2 -","- C18 H6 Cl2 N2 O2 -","- C36 H12 Cl4 N4 O4 -","2","0.5","","Nishida, Jun-ichi; Deno, Hironori; Ichimura, Satoru; Nakagawa, Tomohiro; Yamashita, Yoshiro","Preparation, physical properties and n-type FET characteristics of substituted diindenopyrazinediones and bis(dicyanomethylene) derivatives","Journal of Materials Chemistry","2012","22","10","4483","","10.1039/c2jm14955a","","","0.71075","MoKα","","","0.0572","","","","0.1448","","","","","","1.064","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207503","6.838","0.009","7.76","0.01","13.38","0.013","90","","92.92","0.05","90","","709.1","1.5","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H6 Br2 N2 O2 -","- C18 H6 Br2 N2 O2 -","- C36 H12 Br4 N4 O4 -","2","0.5","","Nishida, Jun-ichi; Deno, Hironori; Ichimura, Satoru; Nakagawa, Tomohiro; Yamashita, Yoshiro","Preparation, physical properties and n-type FET characteristics of substituted diindenopyrazinediones and bis(dicyanomethylene) derivatives","Journal of Materials Chemistry","2012","22","10","4483","","10.1039/c2jm14955a","","","0.71075","MoKα","","","0.0364","","","","0.065","","","","","","0.873","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207504","11.241","0.005","20.08","0.008","10.684","0.005","90","","90","","90","","2411.6","1.8","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C28 H20 N2 O2 S3 -","- C28 H20 N2 O2 S3 -","- C112 H80 N8 O8 S12 -","4","1","","Chen, Shangjun; Yang, Yuheng; Wu, Yue; Tian, He; Zhu, Weihong","Multi-addressable photochromic terarylene containing benzo[b]thiophene-1,1-dioxide unit as ethene bridge: multifunctional molecular logic gates on unimolecular platform","Journal of Materials Chemistry","2012","22","12","5486","","10.1039/c2jm14973g","","","0.71073","MoKα","","0.037","0.0315","","","0.077","0.0811","","","","","","1.054","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207505","13.8921","0.001","15.1742","0.0012","35.456","0.003","88.906","0.006","79.711","0.005","84.143","0.005","7315.6","1","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H52 Si2 -","- C44 H52 Si2 -","- C352 H416 Si16 -","8","4","","Zhang, Lei; Walker, Bright; Liu, Feng; Colella, Nicholas S.; Mannsfeld, Stefan C. B.; Watkins, James J.; Nguyen, Thuc-Quyen; Briseno, Alejandro L.","Triisopropylsilylethynyl-functionalized dibenzo[def,mno]chrysene: a solution-processed small molecule for bulk heterojunction solar cells","Journal of Materials Chemistry","2012","22","10","4266","","10.1039/c2jm14998b","","","1.54178","CuKα","","0.179","0.1081","","","0.2499","0.2877","","","","","","1.04","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207506","10.9857","0.0008","15.0354","0.0008","46.669","0.003","90","","90.149","0.002","90","","7708.5","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","E-2-tricyanovinyl-3-n-hexyl-5-(4-(bis(4-n-butylphenyl)amino)- 2-methoxystyryl)-thiophene","E-2-tricyanovinyl-3-n-hexyl-5- [4-{bis(4-n-butylphenyl)amino}-2-methoxystyryl]-thiophene","","- C44 H48 N4 O S -","- C44 H48 N4 O S -","- C352 H384 N32 O8 S8 -","8","1","","Getmanenko, Yulia A.; Hales, Joel M.; Balu, Mihaela; Fu, Jie; Zojer, Egbert; Kwon, Ohyun; Mendez, Jeffrey; Thayumanavan, S.; Walker, Gregory; Zhang, Qing; Bunge, Scott D.; Brédas, Jean-Luc; Hagan, David J.; Van Stryland, Eric W.; Barlow, Stephen; Marder, Seth R.","Characterisation of a dipolar chromophore with third-harmonic generation applications in the near-IR","Journal of Materials Chemistry","2012","22","10","4371","","10.1039/c2jm15599k","","","0.71073","MoKα","","0.0587","0.0426","","","0.1266","0.143","","","","","","0.99","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207507","12.57","0.001","12.57","0.001","35.496","0.002","90","","90","","120","","4857.1","0.6","122.4","0.5","122.4","0.5","","","","","","","","5","R -3 :H","-R 3","148","N,N',N''-tris(3-methylpentyl)triazatriangulenium tetrafluoroborate","","","- C37 H48 B F4 N3 -","- C37 H48 B F3.99 N3 -","- C222 H288 B6 F23.94 N18 -","6","0.333333","","Sørensen, Thomas Just; Hildebrandt, Christoffer B.; Elm, Jonas; Andreasen, Jens W.; Madsen, Anders Ø.; Westerlund, Fredrik; Laursen, Bo W.","Large area, soft crystalline thin films of N,N′,N′′-trialkyltriazatriangulenium salts with homeotropic alignment of the discotic cores in a lamellar lattice","Journal of Materials Chemistry","2012","22","11","4797","","10.1039/c2jm15954f","","x-ray","0.71073","MoKα","","0.125","0.1003","","","0.3425","0.3734","","","","","","1.563","","","","has coordinates,has disorder","180406","2020-10-21","18:00:00",""
"7207508","5.9625","0.0011","9.3712","0.0018","12.051","0.002","75.207","0.003","88.706","0.003","80.057","0.003","641.1","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H8 F8 I4 N -","- C24 H8 F8 I4 N -","- C24 H8 F8 I4 N -","1","0.5","","Gao, Hai Yue; Shen, Qian Jin; Zhao, Xiao Ran; Yan, Xiao Qing; Pang, Xue; Jin, Wei Jun","Phosphorescent co-crystal assembled by 1,4-diiodotetrafluorobenzene with carbazole based on C‒I⋯π halogen bonding","Journal of Materials Chemistry","2012","22","12","5336","","10.1039/c2jm16257a","","","0.71073","MoKα","","0.041","0.0325","","","0.0746","0.0789","","","","","","1.018","","","","has coordinates,has disorder","180406","2020-10-21","18:00:00",""
"7207509","10.463","0.002","11.737","0.002","12.856","0.003","91.16","0.03","105.66","0.03","114.76","0.03","1364.3","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H23 N5 S2 -","- C26 H23 N5 S2 -","- C52 H46 N10 S4 -","2","1","","Qiao, Yali; Zhang, Jing; Xu, Wei; Zhu, Daoben","Incorporation of pyrrole to oligothiophene-based quinoids endcapped with dicyanomethylene: a new class of solution processable n-channel organic semiconductors for air-stable organic field-effect transistors","Journal of Materials Chemistry","2012","22","12","5706","","10.1039/c2jm16700j","","","0.71073","MoKα","","0.0736","0.0676","","","0.1911","0.1971","","","","","","1.059","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207698","8.9454","0.0007","9.0406","0.0007","12.7473","0.001","90","","90","","90","","1030.9","0.14","223","2","223","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- H4 Li O7 P V -","- H4 Li O7 P V -","- H32 Li8 O56 P8 V8 -","8","","","Shahul Hameed, A.; Nagarathinam, Mangayarkarasi; Reddy, M. V.; Chowdari, B. V. R.; Vittal, Jagadese J.","Synthesis and electrochemical studies of layer-structured metastable αI-LiVOPO4","Journal of Materials Chemistry","2012","22","15","7206","","10.1039/c2jm00062h","","","0.71073","MoKα","","0.0252","0.025","","","0.0679","0.0681","","","","","","1.175","","","","has coordinates","180407","2020-10-21","18:00:00",""
"7207699","9.759","0.004","16.442","0.007","12.446","0.005","90","","110.435","0.011","90","","1871.4","1.3","123","2","123","2","","","","","","","","5","P 1 c 1","P -2yc","7","Choline BScB","2-hydroxy-N,N,N-trimethylethanaminium 4,4'-dioxo-4H, 4'H-2,2'-spirobi[benzo[d][1,3,2]dioxaborinin]-2-uide","","- C38 H30 B2 N2 O14 -","- C38 H30 B2 N2 O14 -","- C76 H60 B4 N4 O28 -","2","1","","Shah, Faiz Ullah; Glavatskih, Sergei; Dean, Pamela M.; MacFarlane, Douglas R.; Forsyth, Maria; Antzutkin, Oleg N.","Halogen-free chelated orthoborate ionic liquids and organic ionic plastic crystals","Journal of Materials Chemistry","2012","22","14","6928","","10.1039/c2jm12657e","","","0.71073","MoKα","","0.1708","0.0741","","","0.178","0.2325","","","","","","0.968","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7207700","12.6085","0.0012","13.1762","0.0013","17.001","0.0016","84.885","0.002","85.729","0.002","82.363","0.002","2782.6","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H46 Cl3 Ir N6 S3 -","- C64 H46 Cl3 Ir N6 S3 -","- C128 H92 Cl6 Ir2 N12 S6 -","2","1","","Yang, Xiaolong; Zhao, Yongbiao; Zhang, Xinwen; Li, Rui; Dang, Jingshuang; Li, Yan; Zhou, Guijiang; Wu, Zhaoxin; Ma, Dongge; Wong, Wai-Yeung; Zhao, Xiang; Ren, Aimin; Wang, Lixiang; Hou, Xun","Thiazole-based metallophosphors of iridium with balanced carrier injection/transporting features and their two-colour WOLEDs fabricated by both vacuum deposition and solution processing-vacuum deposition hybrid strategy","Journal of Materials Chemistry","2012","22","15","7136","","10.1039/c2jm14712b","","","0.71073","MoKα","","0.0726","0.0474","","","0.1129","0.1259","","","","","","1.008","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207701","23.61","0.01","28.05","0.01","32","0.01","67.835","0.003","70.115","0.003","68.953","0.003","17796","11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C216 H117 N8 O51 S4 -","- C216 H117 N8 O51 S4 -","- C432 H234 N16 O102 S8 -","2","1","","Hammond, Scott R.; Sinness, Jessica; Dubbury, Sara; Firestone, Kimberly A.; Benedict, Jason B.; Wawrzak, Zdzislaw; Clot, Olivier; Reid, Philip J.; Dalton, Larry R.","Molecular engineering of nanoscale order in organic electro-optic glasses","Journal of Materials Chemistry","2012","22","14","6752","","10.1039/c2jm14915j","","","0.71","synchrotron","","0.2022","0.1849","","","0.4721","0.4991","","","","","","2.169","","","","has coordinates,has disorder","180408","2020-10-21","18:00:00",""
"7207702","10.411","0.0014","17.316","0.002","24.493","0.003","90","","97.918","0.002","90","","4373.4","0.9","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H40 Li4 N4 O4 -","- C52 H40 Li4 N4 O4 -","- C208 H160 Li16 N16 O16 -","4","1","","Kathirgamanathan, Poopathy; Surendrakumar, Sivagnanasundram; Antipan-Lara, Juan; Ravichandran, Seenivasagam; Chan, Y. F.; Arkley, Vincent; Ganeshamurugan, Subramanium; Kumaraverl, Muttulingham; Paramswara, Gnanamoly; Partheepan, Arumugam; Reddy, Vanga R.; Bailey, Daniel; Blake, Alexander J.","Novel lithium Schiff-base cluster complexes as electron injectors: synthesis, crystal structure, thin film characterisation and their performance in OLEDs","Journal of Materials Chemistry","2012","22","13","6104","","10.1039/c2jm15114f","","","0.71073","MoKα","","0.0632","0.0349","","","0.0755","0.0861","","","","","","0.99","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207703","9.5021","0.0008","18.5086","0.0015","24.385","0.002","90","","90","","90","","4288.6","0.6","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C52 H60 Si2 -","- C52 H60 Si2 -","- C208 H240 Si8 -","4","1","","Zhang, Jingjing; Sarrafpour, Syena; Haas, Terry E.; Müller, Peter; Thomas, Samuel W.","Structure, photophysics, and photooxidation of crowded diethynyltetracenes","Journal of Materials Chemistry","2012","22","13","6182","","10.1039/c2jm16173g","","","0.71073","MoKα","","0.046","0.0364","","","0.0831","0.0889","","","","","","1.036","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207704","7.0225","0.0015","11.456","0.003","22.004","0.006","101.509","0.007","96.474","0.007","104.936","0.005","1650.6","0.7","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C48 H32 O2 -","- C48 H32 O2 -","- C96 H64 O4 -","2","1","","Zhang, Jingjing; Sarrafpour, Syena; Haas, Terry E.; Müller, Peter; Thomas, Samuel W.","Structure, photophysics, and photooxidation of crowded diethynyltetracenes","Journal of Materials Chemistry","2012","22","13","6182","","10.1039/c2jm16173g","","","0.71073","MoKα","","0.0977","0.0551","","","0.131","0.1535","","","","","","1.023","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207705","16.5126","0.0007","16.5126","0.0007","24.5098","0.0014","90","","90","","120","","5787.6","0.5","293","2","293","2","","","","","","","","4","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C27 H17 Ce O7 -","- C27 H15 Ce O6 -","- C162 H90 Ce6 O36 -","6","0.5","","Lin, Zhongjun; Zou, Ruqiang; Liang, Jie; Xia, Wei; Xia, Dingguo; Wang, Yingxia; Lin, Jianhua; Hu, Tongliang; Chen, Qiang; Wang, Xidong; Zhao, Yusheng; Burrell, Anthony K.","Pore size-controlled gases and alcohols separation within ultramicroporous homochiral lanthanide‒organic frameworks","Journal of Materials Chemistry","2012","22","16","7813","","10.1039/c2jm16324a","","","0.71073","MoKα","","0.0652","0.0553","","","0.1479","0.1528","","","","","","1.065","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207706","16.5126","0.0007","16.5126","0.0007","24.5098","0.0014","90","","90","","120","","5787.6","0.5","293","2","293","2","","","","","","","","4","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C27 H17 Ce O7 -","- C27 H15 Ce O7 -","- C162 H90 Ce6 O42 -","6","0.5","","Lin, Zhongjun; Zou, Ruqiang; Liang, Jie; Xia, Wei; Xia, Dingguo; Wang, Yingxia; Lin, Jianhua; Hu, Tongliang; Chen, Qiang; Wang, Xidong; Zhao, Yusheng; Burrell, Anthony K.","Pore size-controlled gases and alcohols separation within ultramicroporous homochiral lanthanide‒organic frameworks","Journal of Materials Chemistry","2012","22","16","7813","","10.1039/c2jm16324a","","","0.71073","MoKα","","0.0794","0.0659","","","0.2041","0.2175","","","","","","1.142","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207707","10.0693","0.0015","8.4668","0.0008","10.377","0.003","90","","118.938","0.007","90","","774.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C0 H2 K O9 S2 Sm -","- H2 K O9 S2 Sm -","- H8 K4 O36 S8 Sm4 -","4","1","","Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu","An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions","Journal of Materials Chemistry","2012","22","14","6831","","10.1039/c2jm16779d","","","0.71073","MoKα","","0.0219","0.021","","","0.0542","0.0548","","","","","","1.078","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207708","10.084","0.01","8.429","0.008","10.363","0.015","90","","119.023","0.016","90","","770.2","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C0 H2 Eu K O9 S2 -","- Eu H2 K O9 S2 -","- Eu4 H8 K4 O36 S8 -","4","1","","Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu","An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions","Journal of Materials Chemistry","2012","22","14","6831","","10.1039/c2jm16779d","","","0.71073","MoKα","","0.041","0.0375","","","0.0858","0.0871","","","","","","1.021","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207709","10.129","0.005","8.391","0.003","10.357","0.007","90","","119.152","0.006","90","","768.8","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C0 H2 Gd K N0 O9 S2 -","- Gd H2 K O9 S2 -","- Gd4 H8 K4 O36 S8 -","4","1","","Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu","An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions","Journal of Materials Chemistry","2012","22","14","6831","","10.1039/c2jm16779d","","","0.71073","MoKα","","0.0237","0.0225","","","0.0569","0.0577","","","","","","1.128","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207710","10.128","0.003","8.3268","0.0011","10.344","0.005","90","","119.305","0.016","90","","760.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C0 H2 K O9 S2 Tb -","- H2 K O9 S2 Tb -","- H8 K4 O36 S8 Tb4 -","4","1","","Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu","An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions","Journal of Materials Chemistry","2012","22","14","6831","","10.1039/c2jm16779d","","","0.71073","MoKα","","0.0197","0.0189","","","0.047","0.0474","","","","","","1.124","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207711","10.107","0.004","8.29","0.003","10.306","0.005","90","","119.318","0.003","90","","752.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C0 H2 Dy K O9 S2 -","- Dy H2 K O9 S2 -","- Dy4 H8 K4 O36 S8 -","4","1","","Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu","An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions","Journal of Materials Chemistry","2012","22","14","6831","","10.1039/c2jm16779d","","","0.71073","MoKα","","0.0195","0.0188","","","0.048","0.0482","","","","","","1.26","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207712","10.079","0.004","8.257","0.003","10.28","0.005","90","","119.285","0.005","90","","746.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- H2 Ho K O9 S2 -","- H2 Ho K O9 S2 -","- H8 Ho4 K4 O36 S8 -","4","1","","Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu","An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions","Journal of Materials Chemistry","2012","22","14","6831","","10.1039/c2jm16779d","","","0.71073","MoKα","","0.0289","0.0243","","","0.0904","0.1338","","","","","","0.801","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207713","10.0682","0.0012","8.2344","0.0008","10.2663","0.0012","90","","119.382","0.01","90","","741.65","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Er4 H8 K4 O36 S8 -","- Er4 H8 K4 O36 S8 -","- Er4 H8 K4 O36 S8 -","1","0.25","","Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu","An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions","Journal of Materials Chemistry","2012","22","14","6831","","10.1039/c2jm16779d","","","0.71073","MoKα","","0.0343","0.0341","","","0.0896","0.0896","","","","","","1.245","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207714","23.169","0.0014","8.6022","0.0005","8.0337","0.0005","90","","90","","90","","1601.15","0.17","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","(E)-2-(5-(nitroimino)-4,5-dihydro-1H-tetrazol-1-yl)acetic acid hydrate","","- C3 H6 N6 O5 -","- C3 H6 N6 O5 -","- C24 H48 N48 O40 -","8","1","","Joo, Young-Hyuk; Gao, Haixiang; Parrish, Damon A.; Cho, Soo Gyeong; Goh, Eun Mee; Shreeve, Jean'ne M.","Energetic salts based on nitroiminotetrazole-containing acetic acid","Journal of Materials Chemistry","2012","22","13","6123","","10.1039/c2jm30322a","","","0.71073","MoKα","","0.036","0.0332","","","0.0927","0.0954","","","","","","1.032","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207715","12.4884","0.0007","5.0947","0.0003","17.4942","0.001","90","","99.941","0.001","90","","1096.35","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1H-tetrazol-1-yl)acetic acid","","- C3 H4 N4 O2 -","- C3 H4 N4 O2 -","- C24 H32 N32 O16 -","8","2","","Joo, Young-Hyuk; Gao, Haixiang; Parrish, Damon A.; Cho, Soo Gyeong; Goh, Eun Mee; Shreeve, Jean'ne M.","Energetic salts based on nitroiminotetrazole-containing acetic acid","Journal of Materials Chemistry","2012","22","13","6123","","10.1039/c2jm30322a","","","0.71073","MoKα","","0.0416","0.0332","","","0.0835","0.0891","","","","","","1.032","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207716","5.4438","0.0008","16.02","0.002","17.071","0.003","90","","92.374","0.002","90","","1487.5","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","bis(4-amino-4H-1,2,4-triazol-1-ium) ((E)-4-(carboxylatomethyl)-5- (nitroimino)-4,5-dihydrotetrazol-1-ide)","","- C7 H12 N14 O4 -","- C7 H12 N14 O4 -","- C28 H48 N56 O16 -","4","1","","Joo, Young-Hyuk; Gao, Haixiang; Parrish, Damon A.; Cho, Soo Gyeong; Goh, Eun Mee; Shreeve, Jean'ne M.","Energetic salts based on nitroiminotetrazole-containing acetic acid","Journal of Materials Chemistry","2012","22","13","6123","","10.1039/c2jm30322a","","","0.71073","MoKα","","0.0486","0.0354","","","0.089","0.0968","","","","","","1.051","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207717","4.12","0.03","11.09","0.11","52.8","0.6","90","","90","","90","","2412","4","123","2","123","2","","","","","","","","3","P b c m","-P 2c 2b","57","_C6-DBTDT","_C6-DBTDT","","- C28 H32 S3 -","- C28 H32 S3 -","- C112 H128 S12 -","4","0.5","","Miyata, Yasuo; Yoshikawa, Eiji; Minari, Takeo; Tsukagoshi, Kazuhito; Yamaguchi, Shigehiro","High-performance organic field-effect transistors based on dihexyl-substituted dibenzo[d,d′]thieno[3,2-b;4,5-b′]dithiophene","Journal of Materials Chemistry","2012","22","16","7715","","10.1039/c2jm30840a","","","0.7107","MoKα","","0.1328","0.1186","","","0.3177","0.3325","","","","","","1.519","","","","has coordinates","180408","2020-10-21","18:00:00",""
"7207900","18.7594","0.0009","18.7594","","15.4559","0.0011","90","","90","","120","","4710.5","0.4","100","2","100","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","","","","- C48 H36 Eu N7 O6 -","- C48 H36 Eu N7 O6 -","- C192 H144 Eu4 N28 O24 -","4","0.333333","","Yan, Cheng; Li, Kang; Wei, Shi-Chao; Wang, Hai-Ping; Fu, Lei; Pan, Mei; Su, Cheng-Yong","Lanthanide homometallic and d‒f heterometallic MOFs from the same tripodal ligand: structural comparison, one photon (OP) vs. two photon (TP) luminescence and selective guest adsorption behavior","Journal of Materials Chemistry","2012","22","19","9846","","10.1039/c2jm00001f","","","0.71073","MoKα","","0.1054","0.0625","","","0.1656","0.2013","","","","","","1.069","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207901","13.072","0.001","14.325","0.001","16.928","0.002","96.764","0.002","112.235","0.012","93.165","0.005","2896.5","0.5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C112 H120 Cl4 Eu2 N18 O21 Zn2 -","- C112 H108 Cl4 Eu2 N18 O21 Zn2 -","- C112 H108 Cl4 Eu2 N18 O21 Zn2 -","1","0.5","","Yan, Cheng; Li, Kang; Wei, Shi-Chao; Wang, Hai-Ping; Fu, Lei; Pan, Mei; Su, Cheng-Yong","Lanthanide homometallic and d‒f heterometallic MOFs from the same tripodal ligand: structural comparison, one photon (OP) vs. two photon (TP) luminescence and selective guest adsorption behavior","Journal of Materials Chemistry","2012","22","19","9846","","10.1039/c2jm00001f","","","0.71073","MoKα","","0.1605","0.0975","","","0.2179","0.2618","","","","","","1.064","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207902","10.3673","0.0005","14.631","0.0008","9.1018","0.0005","90","","105.698","0.003","90","","1329.1","0.12","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N6 O2 -","- C12 H16 N6 O2 -","- C48 H64 N24 O8 -","4","1","","Bohlender, Carmen; Wolfram, Martin; Goerls, Helmar; Imhof, Wolfgang; Menzel, Roberto; Baumgaertel, Anja; Schubert, Ulrich S.; Mueller, Ulrike; Frigge, Martina; Schnabelrauch, Matthias; Wyrwa, Ralf; Schiller, Alexander","Light-triggered NO release from a nanofibrous non-woven","Journal of Materials Chemistry","2012","22","18","8785","","10.1039/c2jm15410b","","","0.71073","MoKα","","0.0758","0.0426","","","0.0952","0.1098","","","","","","0.956","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207903","11.4171","0.0007","11.8541","0.0009","12.1504","0.0009","81.797","0.004","73.957","0.005","75.363","0.005","1524.4","0.19","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H16 N6 O2 -","- C16 H16 N6 O2 -","- C64 H64 N24 O8 -","4","2","","Bohlender, Carmen; Wolfram, Martin; Goerls, Helmar; Imhof, Wolfgang; Menzel, Roberto; Baumgaertel, Anja; Schubert, Ulrich S.; Mueller, Ulrike; Frigge, Martina; Schnabelrauch, Matthias; Wyrwa, Ralf; Schiller, Alexander","Light-triggered NO release from a nanofibrous non-woven","Journal of Materials Chemistry","2012","22","18","8785","","10.1039/c2jm15410b","","","0.71073","MoKα","","0.123","0.0538","","","0.1061","0.1295","","","","","","0.957","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207904","8.0329","0.0007","10.7389","0.0007","12.3584","0.0009","91.756","0.006","97.964","0.004","104.935","0.005","1017.69","0.14","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H17 Cl N8 O3 Ru -","- C18 H17 Cl N8 O3 Ru -","- C36 H34 Cl2 N16 O6 Ru2 -","2","1","","Bohlender, Carmen; Wolfram, Martin; Goerls, Helmar; Imhof, Wolfgang; Menzel, Roberto; Baumgaertel, Anja; Schubert, Ulrich S.; Mueller, Ulrike; Frigge, Martina; Schnabelrauch, Matthias; Wyrwa, Ralf; Schiller, Alexander","Light-triggered NO release from a nanofibrous non-woven","Journal of Materials Chemistry","2012","22","18","8785","","10.1039/c2jm15410b","","","0.71073","MoKα","","0.0867","0.0511","","","0.0971","0.1104","","","","","","1.015","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207905","12.1","0.003","26.162","0.004","26.162","0.003","90","","90","","90","","8282","3","291","2","291","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C37 H28 Cu4 O24 -","- C37 H28 Cu4 O24 -","- C148 H112 Cu16 O96 -","4","0.5","","Xue, Yun-Shan; He, Yabing; Ren, Shi-Bin; Yue, Yanfeng; Zhou, Le; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng; Chen, Banglin","A robust microporous metal‒organic framework constructed from a flexible organic linker for acetylene storage at ambient temperature","Journal of Materials Chemistry","2012","22","20","10195","","10.1039/c2jm15538a","","","0.71073","MoKα","","0.0627","0.0468","","","0.1129","0.12","","","","","","1.069","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207906","19.357","0.002","19.357","0.002","19.357","0.002","90","","90","","90","","7252.9","1.3","200","2","200","2","","","","","","","","6","P m -3 m","-P 4 2 3","221","","","","- C24 H8 Cd4 Cl N32 O4 -","- C24 H8 Cd4 Cl N32 O4 -","- C72 H24 Cd12 Cl3 N96 O12 -","3","0.0625","","Biswas, Shyam; Maes, Michael; Dhakshinamoorthy, Amarajothi; Feyand, Mark; De Vos, Dirk E.; Garcia, Hermenegildo; Stock, Norbert","Fuel purification, Lewis acid and aerobic oxidation catalysis performed by a microporous Co-BTT (BTT3− = 1,3,5-benzenetristetrazolate) framework having coordinatively unsaturated sites","Journal of Materials Chemistry","2012","22","20","10200","","10.1039/c2jm15592c","","","0.71073","MoKα","","0.0548","0.0406","","","0.1007","0.1058","","","","","","1.142","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207907","18.739","0.002","18.739","0.002","18.739","0.002","90","","90","","90","","6580.2","1.2","293","2","293","2","","","","","","","","6","P m -3 m","-P 4 2 3","221","","","","- C24 H8 Cl Co4 N32 O4 -","- C24 H8 Cl Co4 N32 O4 -","- C72 H24 Cl3 Co12 N96 O12 -","3","0.0625","","Biswas, Shyam; Maes, Michael; Dhakshinamoorthy, Amarajothi; Feyand, Mark; De Vos, Dirk E.; Garcia, Hermenegildo; Stock, Norbert","Fuel purification, Lewis acid and aerobic oxidation catalysis performed by a microporous Co-BTT (BTT3− = 1,3,5-benzenetristetrazolate) framework having coordinatively unsaturated sites","Journal of Materials Chemistry","2012","22","20","10200","","10.1039/c2jm15592c","","","0.71073","MoKα","","0.0803","0.0782","","","0.2359","0.2379","","","","","","1.251","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207908","14.3035","0.0003","14.3035","0.0003","15.9627","0.0006","90","","90","","90","","3265.81","0.16","100","2","100","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C32 H46 N4 O8 Zn -","- C32 H46 N4 O8 Zn -","- C128 H184 N16 O32 Zn4 -","4","0.5","","Huang, Qian; Cai, Jianfeng; Wu, Hui; He, Yabing; Chen, Banglin; Qian, Guodong","A robust microporous metal‒organic framework constructed from a flexible organic linker for highly selective sorption of methanol over ethanol and water","Journal of Materials Chemistry","2012","22","20","10352","","10.1039/c2jm15604k","","","0.71073","MoKα","","0.0648","0.0616","","","0.1256","0.127","","","","","","1.194","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207909","14.4835","0.0012","14.4835","","15.4118","0.0016","90","","90","","90","","3233","0.4","298","","298","","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C30 H38 N4 O6 Zn -","- C30 H38 N4 O6 Zn -","- C120 H152 N16 O24 Zn4 -","4","0.5","","Huang, Qian; Cai, Jianfeng; Wu, Hui; He, Yabing; Chen, Banglin; Qian, Guodong","A robust microporous metal‒organic framework constructed from a flexible organic linker for highly selective sorption of methanol over ethanol and water","Journal of Materials Chemistry","2012","22","20","10352","","10.1039/c2jm15604k","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","0.11546","","4.91","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207910","16.5428","0.0004","16.5428","0.0004","24.3988","0.0015","90","","90","","120","","5782.5","0.4","296","2","296","2","","","","","","","","4","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C27 H15 La O7 -","- C27 H15 La O7 -","- C162 H90 La6 O42 -","6","0.5","","Mu, Bin; Li, Feng; Huang, Yougui; Walton, Krista S.","Breathing effects of CO2 adsorption on a flexible 3D lanthanide metal‒organic framework","Journal of Materials Chemistry","2012","22","20","10172","","10.1039/c2jm15721g","","","1.54178","CuKα","","0.0565","0.055","","","0.1508","0.1522","","","","","","1.08","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7207911","10.073","0.005","34.113","0.017","6.791","0.003","90","","113.866","0.007","90","","2134","1.8","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","ZnTBC","","","- C8 H4 N4 O2 Zn -","- C8 H4 N4 O2 Zn -","- C64 H32 N32 O16 Zn8 -","8","1","","Wei, Qiang; Yang, Dali; Larson, Toti Eric; Kinnibrugh, Tiffany L.; Zou, Ruqiang; Henson, Neil J.; Timofeeva, Tatiana; Xu, Hongwu; Zhao, Yusheng; Mattes, Benjamin R.","Kinetic hysteresis in gas adsorption behavior for a rigid MOF arising from zig-zag channel structures","Journal of Materials Chemistry","2012","22","20","10166","","10.1039/c2jm15860d","","","0.71073","MoKα","","0.1289","0.1119","","","0.2343","0.2429","","","","","","1.259","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207912","6.791","0.003","9.604","0.004","17.722","0.01","101.826","0.01","96.5","0.01","106.425","0.007","1067","0.9","110","2","110","2","","","","","","","","5","P -1","-P 1","2","ZnTBC","","","- C16 H8 N8 O6.3 Zn2 -","- C16 H8 N8 O6.3 Zn2 -","- C32 H16 N16 O12.6 Zn4 -","2","1","","Wei, Qiang; Yang, Dali; Larson, Toti Eric; Kinnibrugh, Tiffany L.; Zou, Ruqiang; Henson, Neil J.; Timofeeva, Tatiana; Xu, Hongwu; Zhao, Yusheng; Mattes, Benjamin R.","Kinetic hysteresis in gas adsorption behavior for a rigid MOF arising from zig-zag channel structures","Journal of Materials Chemistry","2012","22","20","10166","","10.1039/c2jm15860d","","","0.71073","MoKα","","0.1311","0.1051","","","0.2687","0.2864","","","","","","1.04","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207913","18.401","0.001","18.401","0.001","44.057","0.003","90","","90","","120","","12919","1.3","293","2","293","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C24 H12.25 O14 Zn4.13 -","- C25.5 H12.255 O14 Zn4.125 -","- C306 H147.06 O168 Zn49.5 -","12","0.333333","","Yao, Qingxia; Su, Jie; Cheung, Ocean; Liu, Qingling; Hedin, Niklas; Zou, Xiaodong","Interpenetrated metal‒organic frameworks and their uptake of CO2 at relatively low pressures","Journal of Materials Chemistry","2012","22","20","10345","","10.1039/c2jm15933c","","","0.71073","MoKα","","0.1143","0.089","","","0.2153","0.2308","","","","","","1.098","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207914","18.6086","0.0008","20.2422","0.0007","20.8135","0.0007","70.421","0.003","68.955","0.003","68.031","0.004","6600.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C75 H50 N O31.7 Zn8 -","- C75 H49 N O31.7 Zn8 -","- C150 H98 N2 O63.4 Zn16 -","2","1","","Yao, Qingxia; Su, Jie; Cheung, Ocean; Liu, Qingling; Hedin, Niklas; Zou, Xiaodong","Interpenetrated metal‒organic frameworks and their uptake of CO2 at relatively low pressures","Journal of Materials Chemistry","2012","22","20","10345","","10.1039/c2jm15933c","","","0.71073","MoKα","","0.0916","0.059","","","0.1616","0.1745","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207915","18.377","0.0006","17.3043","0.0004","17.9565","0.0005","90","","90","","90","","5710.2","0.3","293","2","293","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C33 H24 N O15 Zn4 -","- C33 H24 N O15 Zn4 -","- C132 H96 N4 O60 Zn16 -","4","0.5","","Yao, Qingxia; Su, Jie; Cheung, Ocean; Liu, Qingling; Hedin, Niklas; Zou, Xiaodong","Interpenetrated metal‒organic frameworks and their uptake of CO2 at relatively low pressures","Journal of Materials Chemistry","2012","22","20","10345","","10.1039/c2jm15933c","","","0.71073","MoKα","","0.0738","0.0545","","","0.1828","0.1937","","","","","","1.086","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207916","17.2914","0.0014","21.5371","0.0018","21.8259","0.0018","112.183","0.0015","98.9048","0.0015","108.721","0.0015","6766.1","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C67.06 H46.64 B2 F24 O5.26 S4 -","- C67.056 H46.64 B2 F24 O5.264 S4 -","- C268.224 H186.56 B8 F96 O21.056 S16 -","4","2","","Sarkar, Arindam; Pal, Sushanta K.; Itkis, Mikhail E.; Tham, Fook S.; Haddon, Robert C.","Sulfur and selenium substituted spiro-biphenalenyl-boron neutral radicals","Journal of Materials Chemistry","2012","22","17","8245","","10.1039/c2jm16001c","","","0.71073","MoKα","","0.0884","0.0485","","","0.1226","0.1484","","","","","","1.055","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207917","19.019","0.004","8.5496","0.0016","18.248","0.003","90","","106.965","0.004","90","","2838.1","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 B O4 S4 -","- C34 H30 B O4 S4 -","- C136 H120 B4 O16 S16 -","4","0.5","","Sarkar, Arindam; Pal, Sushanta K.; Itkis, Mikhail E.; Tham, Fook S.; Haddon, Robert C.","Sulfur and selenium substituted spiro-biphenalenyl-boron neutral radicals","Journal of Materials Chemistry","2012","22","17","8245","","10.1039/c2jm16001c","","","0.71073","MoKα","","0.0468","0.0345","","","0.0865","0.0933","","","","","","1.02","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207918","19.171","0.003","8.6743","0.0015","18.273","0.003","90","","106.829","0.003","90","","2908.6","0.8","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 B O4 S4 -","- C34 H30 B O4 S4 -","- C136 H120 B4 O16 S16 -","4","0.5","","Sarkar, Arindam; Pal, Sushanta K.; Itkis, Mikhail E.; Tham, Fook S.; Haddon, Robert C.","Sulfur and selenium substituted spiro-biphenalenyl-boron neutral radicals","Journal of Materials Chemistry","2012","22","17","8245","","10.1039/c2jm16001c","","","0.71073","MoKα","","0.0713","0.0434","","","0.1034","0.1166","","","","","","1.024","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207919","27.3177","0.0007","21.9323","0.0006","18.558","0.0005","90","","116.751","0.0004","90","","9928.8","0.5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H38 B O4 S4 -","- C38 H38 B O4 S4 -","- C456 H456 B12 O48 S48 -","12","1.5","","Sarkar, Arindam; Pal, Sushanta K.; Itkis, Mikhail E.; Tham, Fook S.; Haddon, Robert C.","Sulfur and selenium substituted spiro-biphenalenyl-boron neutral radicals","Journal of Materials Chemistry","2012","22","17","8245","","10.1039/c2jm16001c","","","0.71073","MoKα","","0.0389","0.0297","","","0.0819","0.0869","","","","","","1.012","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207920","9.3401","0.0002","22.0917","0.0006","16.6081","0.0004","90","","92.7623","0.0004","90","","3422.91","0.14","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H38 B O4 S4 -","- C38 H38 B O4 S4 -","- C152 H152 B4 O16 S16 -","4","0.5","","Sarkar, Arindam; Pal, Sushanta K.; Itkis, Mikhail E.; Tham, Fook S.; Haddon, Robert C.","Sulfur and selenium substituted spiro-biphenalenyl-boron neutral radicals","Journal of Materials Chemistry","2012","22","17","8245","","10.1039/c2jm16001c","","","0.71073","MoKα","","0.0524","0.04","","","0.1097","0.1214","","","","","","1.022","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207921","6.5672","0.0004","8.5035","0.0006","9.6637","0.0006","90","","101.351","0.004","90","","529.11","0.06","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- B6 Ba3 F2 O11 -","- B6 Ba3 F2 O11 -","- B12 Ba6 F4 O22 -","2","1","","Yu, Hongwei; Wu, Hongping; Pan, Shilie; Yang, Zhihua; Su, Xin; Zhang, Fangfang","A novel deep UV nonlinear optical crystal Ba3B6O11F2, with a new fundamental building block, B6O14 group","Journal of Materials Chemistry","2012","22","19","9665","","10.1039/c2jm16058g","","","0.71073","MoKα","","0.0263","0.0259","","","0.0632","0.0637","","","","","","1.056","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207922","31.748","0.001","9.875","0.001","7.028","0.002","90","","91.53","0.04","90","","2202.6","0.7","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H18 O5 V -","- C30 H18 O5 V -","- C120 H72 O20 V4 -","4","0.5","","Djerdj, Igor; Popović, Jasminka; Stare, Jernej; Ambrožič, Gabriela; Škapin, Srečo D.; Kozlevčar, Bojan; Pajić, Damir; Jagličić, Zvonko; Orel, Zorica Crnjak","Nanocrystalline hybrid inorganic‒organic one-dimensional chain systems tailored with 2- and 3-phenyl ring monocarboxylic acids","Journal of Materials Chemistry","2012","22","20","10255","","10.1039/c2jm16213j","powder diffraction","","1.54056","CuKα","","","","","","","","","10.7891","","","","","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207923","10.0875","0.0015","25.41","0.004","6.831","0.002","90","","90","","90","","1750.9","0.6","293","","293","","","","","","","","","4","P 21 c n","P -2n 2a","33","","","","- C22 H14 O5 V -","- C22 H14 O5 V -","- C88 H56 O20 V4 -","4","1","","Djerdj, Igor; Popović, Jasminka; Stare, Jernej; Ambrožič, Gabriela; Škapin, Srečo D.; Kozlevčar, Bojan; Pajić, Damir; Jagličić, Zvonko; Orel, Zorica Crnjak","Nanocrystalline hybrid inorganic‒organic one-dimensional chain systems tailored with 2- and 3-phenyl ring monocarboxylic acids","Journal of Materials Chemistry","2012","22","20","10255","","10.1039/c2jm16213j","powder diffraction","","1.54056","CuKα","","","","","","","","","8.1267","","","","","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207924","12.335","0.004","12.335","0.004","5.265","0.003","90","0.005","90","0.005","90","0.005","801.1","0.6","100","2","100","2","","","","","","","synthesis as described","6","P 41","P 4w","76","","","","- C5 H9 Co N O6 S -","- C5 H7 Co N O5.5 S -","- C20 H28 Co4 N4 O22 S4 -","4","1","","Rossin, Andrea; Di Credico, Barbara; Giambastiani, Giuliano; Peruzzini, Maurizio; Pescitelli, Gennaro; Reginato, Gianna; Borfecchia, Elisa; Gianolio, Diego; Lamberti, Carlo; Bordiga, Silvia","Synthesis, characterization and CO2 uptake of a chiral Co(ii) metal‒organic framework containing a thiazolidine-based spacer","Journal of Materials Chemistry","2012","22","20","10335","","10.1039/c2jm16236a","","x-ray","0.71069","MoKα","","0.0333","0.028","","","0.061","0.0627","","","","","","0.996","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207925","23.5793","0.0002","18.6265","0.0001","30.1227","0.0002","90","","93.223","0.001","90","","13209","0.16","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C320 H140 N12 O136 Zn32 -","- C80 H35 N3 O34 Zn8 -","- C320 H140 N12 O136 Zn32 -","4","1","","Perry IV, John J.; Feng, Patrick L.; Meek, Scott T.; Leong, Kirsty; Doty, F. Patrick; Allendorf, Mark D.","Connecting structure with function in metal‒organic frameworks to design novel photo- and radioluminescent materials","Journal of Materials Chemistry","2012","22","20","10235","","10.1039/c2jm16627e","","","1.54184","CuKα","","0.1354","0.1318","","","0.3614","0.363","","","","","","1.111","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207926","12.4451","0.0004","20.361","0.0006","7.0378","0.0003","90","","101.38","0.004","90","","1748.28","0.11","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 4,6-Dimethoxy-3-phenyl-1H-indene-2-carboxylate","","- C20 H20 O4 -","- C20 H20 O4 -","- C80 H80 O16 -","4","1","","Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore","Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives","Journal of Materials Chemistry","2012","22","19","9611","","10.1039/c2jm16790e","","","0.71073","MoKα","","0.1526","0.0421","","","0.0776","0.0919","","","","","","0.744","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207927","12.466","0.004","19.438","0.006","7.173","0.003","90","","98.53","0.04","90","","1718.9","1.1","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 4,6-Dimethoxy-1-oxo-3-phenyl-1H-indene-2-carboxylate","","- C20 H18 O5 -","- C20 H18 O5 -","- C80 H72 O20 -","4","1","","Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore","Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives","Journal of Materials Chemistry","2012","22","19","9611","","10.1039/c2jm16790e","","","0.71073","MoKα","","0.3231","0.1246","","","0.3005","0.3417","","","","","","0.838","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207928","31.289","0.005","8.588","0.005","27.715","0.005","90","","102.051","0.005","90","","7283","5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C42 H40 O8 -","- C42 H40 O8 -","- C336 H320 O64 -","8","1","","Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore","Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives","Journal of Materials Chemistry","2012","22","19","9611","","10.1039/c2jm16790e","","","0.71073","MoKα","","0.2308","0.0403","","","0.059","0.077","","","","","","0.624","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207929","11.3555","0.0006","13.2852","0.0007","15.0996","0.0008","114.224","0.005","98.647","0.004","107.133","0.004","1886.6","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C43 H44 O9 -","- C43 H44 O8.5 -","- C86 H88 O17 -","2","1","","Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore","Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives","Journal of Materials Chemistry","2012","22","19","9611","","10.1039/c2jm16790e","","","0.71073","MoKα","","0.1482","0.0554","","","0.1342","0.1524","","","","","","0.802","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207930","15.7773","0.0006","11.5001","0.0004","20.4105","0.0008","90","","90.792","0.003","90","","3702.9","0.2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Ethyl 4,5,6-Trimethoxy-1-oxo-3-phenyl-1H-indene-2-carboxylate","","- C21 H20 O6 -","- C21 H20 O6 -","- C168 H160 O48 -","8","1","","Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore","Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives","Journal of Materials Chemistry","2012","22","19","9611","","10.1039/c2jm16790e","","","0.71073","MoKα","","0.0695","0.0448","","","0.1179","0.1254","","","","","","1.027","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207931","19.246","0.003","23.211","0.005","17.018","0.002","90","","90","","90","","7602","2","293","2","293","2","","","","","","","","3","P n c a","-P 2a 2n","60","","","","- C44 H44 O10 -","- C44 H44 O10 -","- C352 H352 O80 -","8","1","","Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore","Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives","Journal of Materials Chemistry","2012","22","19","9611","","10.1039/c2jm16790e","","","0.71073","MoKα","","0.3901","0.0552","","","0.0664","0.1096","","","","","","0.652","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207932","11.914","","18.91","","20.176","","63.59","","82.53","","74.28","","3918.62","","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H44 O10 -","- C44 H44 O10 -","- C176 H176 O40 -","4","2","","Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore","Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives","Journal of Materials Chemistry","2012","22","19","9611","","10.1039/c2jm16790e","","","0.71073","MoKα","","0.1392","0.05","","","0.1121","0.1291","","","","","","0.799","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207933","13.9165","0.0002","12.2744","0.0002","14.511","0.0002","90","","100.017","0.002","90","","2440.94","0.06","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H48 N6 O2 S2 -","- C60 H48 N6 O2 S2 -","- C120 H96 N12 O4 S4 -","2","0.5","","Ting, Hao-Chun; Chen, You-Ming; You, Hong-Wei; Hung, Wen-Yi; Lin, Sheng-Hsun; Chaskar, Atul; Chou, Shu-Hua; Chi, Yun; Liu, Rai-Hsung; Wong, Ken-Tsung","Indolo[3,2-b]carbazole/benzimidazole hybrid bipolar host materials for highly efficient red, yellow, and green phosphorescent organic light emitting diodes","Journal of Materials Chemistry","2012","22","17","8399","","10.1039/c2jm30207a","","","1.54178","CuKα","","0.073","0.0573","","","0.1689","0.1784","","","","","","1.256","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207934","9.3415","0.0006","10.0537","0.0007","11.5245","0.0009","106.117","0.007","99.662","0.006","93.529","0.005","1018.35","0.13","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","","","- C56 H36 N6 -","- C56 H36 N6 -","- C56 H36 N6 -","1","0.5","","Ting, Hao-Chun; Chen, You-Ming; You, Hong-Wei; Hung, Wen-Yi; Lin, Sheng-Hsun; Chaskar, Atul; Chou, Shu-Hua; Chi, Yun; Liu, Rai-Hsung; Wong, Ken-Tsung","Indolo[3,2-b]carbazole/benzimidazole hybrid bipolar host materials for highly efficient red, yellow, and green phosphorescent organic light emitting diodes","Journal of Materials Chemistry","2012","22","17","8399","","10.1039/c2jm30207a","","","1.54178","CuKα","","0.0617","0.047","","","0.1332","0.1538","","","","","","1.001","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207935","18.037","0.002","24.308","0.003","6.9817","0.0009","90","","90","","90","","3061.1","0.6","293","2","293","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C29 H28 Er N O10 -","- C26 H15 Er O9 -","- C104 H60 Er4 O36 -","4","0.5","","Dang, Song; Zhang, Jian-Han; Sun, Zhong-Ming","Tunable emission based on lanthanide(iii) metal‒organic frameworks: an alternative approach to white light","Journal of Materials Chemistry","2012","22","18","8868","","10.1039/c2jm30389b","","","0.71073","MoKα","","0.0274","0.0253","","","0.0616","0.0625","","","","","","1.077","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207936","18.0366","0.001","24.1755","0.0013","6.9866","0.0004","90","","90","","90","","3046.5","0.3","293","2","293","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C29 H28 N O10 Y -","- C26 H15 O9 Y -","- C104 H60 O36 Y4 -","4","0.5","","Dang, Song; Zhang, Jian-Han; Sun, Zhong-Ming","Tunable emission based on lanthanide(iii) metal‒organic frameworks: an alternative approach to white light","Journal of Materials Chemistry","2012","22","18","8868","","10.1039/c2jm30389b","","","0.71073","MoKα","","0.056","0.0489","","","0.1217","0.1255","","","","","","1.084","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207937","11.8193","0.0013","11.9602","0.0013","12.5652","0.0014","101.79","0.001","92.784","0.001","112.516","0.001","1590.3","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H35 Cd N5 O9 -","- C30 H35 Cd N5 O9 -","- C60 H70 Cd2 N10 O18 -","2","1","","Chen, Cheng-Xia; Liu, Qi-Kui; Ma, Jian-Ping; Dong, Yu-Bin","Encapsulation of Ln3+ hydrate species for tunable luminescent materials based on a porous Cd(ii)-MOF","Journal of Materials Chemistry","2012","22","18","9027","","10.1039/c2jm30419h","","","0.71073","MoKα","","0.0372","0.0351","","","0.0929","0.0949","","","","","","1.064","","","","has coordinates,has disorder","180410","2020-10-21","18:00:00",""
"7207938","8.9084","0.0018","7.2253","0.0018","9.172","0.003","90","","95.55","0.03","90","","587.6","0.3","383","2","383","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C9 H11 Cl N O4 -","- C9 H11 Cl N O4 -","- C18 H22 Cl2 N2 O8 -","2","0.5","","Zhang, Yi; Awaga, Kunio; Yoshikawa, Hirofumi; Xiong, Ren-Gen","Ferroelastic phase transition and dielectric anomalies in 2,4,6-trimethylanilinium perchlorate","Journal of Materials Chemistry","2012","22","19","9841","","10.1039/c2jm30581j","","","0.71073","MoKα","","0.0806","0.063","","","0.213","0.2401","","","","","","0.97","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7207939","7.1581","0.0014","8.5937","0.0017","9.0642","0.0018","88.74","0.03","79.19","0.03","87.02","0.03","546.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H14 Cl N O4 -","- C9 H14 Cl N O4 -","- C18 H28 Cl2 N2 O8 -","2","1","","Zhang, Yi; Awaga, Kunio; Yoshikawa, Hirofumi; Xiong, Ren-Gen","Ferroelastic phase transition and dielectric anomalies in 2,4,6-trimethylanilinium perchlorate","Journal of Materials Chemistry","2012","22","19","9841","","10.1039/c2jm30581j","","","0.71073","MoKα","","0.0979","0.079","","","0.2001","0.2151","","","","","","1.076","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7207940","5.0378","0.0001","5.2691","0.0001","8.8985","0.0002","90","","90","","90","","236.208","0.008","296","2","296","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- Mg Mo O6 Te -","- Mg Mo O6 Te -","- Mg2 Mo2 O12 Te2 -","2","0.5","","Zhang, Junjie; Zhang, Zhonghan; Sun, Youxuan; Zhang, Chengqian; Zhang, Shaojun; Liu, Yang; Tao, Xutang","MgTeMoO6: A neutral layered material showing strong second-harmonic generation","Journal of Materials Chemistry","2012","22","19","9921","","10.1039/c2jm30953j","","","0.71073","MoKα","","0.015","0.0149","","","0.0372","0.0373","","","","","","1.043","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7208026","12.3979","0.0002","19.2597","0.0004","13.7144","0.0003","90","","94.1952","0.001","90","","3265.95","0.11","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 F6 N6 Os P2 -","- C32 H30 F6 N6 Os P2 -","- C128 H120 F24 N24 Os4 P8 -","4","1","","Lin, Cheng-Huei; Hsu, Che-Wei; Liao, Jia-Ling; Cheng, Yi-Ming; Chi, Yun; Lin, Tsung-Yi; Chung, Min-Wen; Chou, Pi-Tai; Lee, Gene-Hsiang; Chang, Chih-Hao; Shih, Chin-Yao; Ho, Chi-Lung","Phosphorescent OLEDs assembled using Os(ii) phosphors and a bipolar host material consisting of both carbazole and dibenzophosphole oxide","Journal of Materials Chemistry","2012","22","21","10684","","10.1039/c2jm16674g","","","0.71073","MoKα","","0.0646","0.043","","","0.1104","0.1173","","","","","","1.068","","","","has coordinates,has disorder","180411","2020-10-21","18:00:00",""
"7208027","8.1571","0.0004","16.5407","0.0009","33.1095","0.0018","90","","90","","90","","4467.3","0.4","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C30 H20 N O P -","- C30 H20 N O P -","- C240 H160 N8 O8 P8 -","8","1","","Lin, Cheng-Huei; Hsu, Che-Wei; Liao, Jia-Ling; Cheng, Yi-Ming; Chi, Yun; Lin, Tsung-Yi; Chung, Min-Wen; Chou, Pi-Tai; Lee, Gene-Hsiang; Chang, Chih-Hao; Shih, Chin-Yao; Ho, Chi-Lung","Phosphorescent OLEDs assembled using Os(ii) phosphors and a bipolar host material consisting of both carbazole and dibenzophosphole oxide","Journal of Materials Chemistry","2012","22","21","10684","","10.1039/c2jm16674g","","","0.71073","MoKα","","0.0779","0.0548","","","0.1239","0.1413","","","","","","1.112","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208028","3.8836","0.0011","18.718","0.005","10.383","0.003","90","","94.058","0.005","90","","752.9","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","6,13-dichloropentacene","","","- C22 H12 Cl2 -","- C22 H12 Cl2 -","- C44 H24 Cl4 -","2","0.5","","Li, Jie; Wang, Mao; Ren, Shendong; Gao, Xike; Hong, Wei; Li, Hongxiang; Zhu, Daoben","High performance organic thin film transistor based on pentacene derivative: 6,13-dichloropentacene","Journal of Materials Chemistry","2012","22","21","10496","","10.1039/c2jm16871e","","","0.71073","MoKα","","0.0669","0.048","","","0.1044","0.1127","","","","","","1.09","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208029","10.089","0.005","22.846","0.005","16.127","0.005","90","0.005","100.922","0.005","90","0.005","3650","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H24 F10 Ir N8 P -","- C37 H24 F10 Ir N8 P -","- C148 H96 F40 Ir4 N32 P4 -","4","1","","Shan, Guo-Gang; Li, Hai-Bin; Zhu, Dong-Xia; Su, Zhong-Min; Liao, Yi","Intramolecular π-stacking in cationic iridium(iii) complexes with a triazole‒pyridine type ancillary ligand: synthesis, photophysics, electrochemistry properties and piezochromic behavior","Journal of Materials Chemistry","2012","22","25","12736","","10.1039/c2jm30480e","","","0.71069","MoKα","","0.092","0.0408","","","0.0484","0.0568","","","","","","0.986","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208030","14.169","0.005","15.705","0.005","17.649","0.005","109.763","0.005","90.435","0.005","91.581","0.005","3694","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H30 F6 Ir N6 P -","- C41 H30 F6 Ir N6 P -","- C164 H120 F24 Ir4 N24 P4 -","4","2","","Shan, Guo-Gang; Li, Hai-Bin; Zhu, Dong-Xia; Su, Zhong-Min; Liao, Yi","Intramolecular π-stacking in cationic iridium(iii) complexes with a triazole‒pyridine type ancillary ligand: synthesis, photophysics, electrochemistry properties and piezochromic behavior","Journal of Materials Chemistry","2012","22","25","12736","","10.1039/c2jm30480e","","","0.71069","MoKα","","0.1134","0.0565","","","0.1232","0.1565","","","","","","1.008","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208031","19.348","0.018","31.17","0.03","9.522","0.008","90","","90","","90","","5743","9","293","2","293","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C52 H54 Cd Cl2 N4 O23 -","- C52 H40 Cd Cl2 N4 O23 -","- C208 H160 Cd4 Cl8 N16 O92 -","4","0.25","","Sun, Jian-Ke; Wang, Peng; Yao, Qing-Xia; Chen, Yong-Juan; Li, Zhao-Hui; Zhang, Yong-Fan; Wu, Li-Ming; Zhang, Jie","Solvent- and anion-controlled photochromism of viologen-based metal‒organic hybrid materials","Journal of Materials Chemistry","2012","22","24","12212","","10.1039/c2jm30558e","","","0.71073","MoKα","","0.0923","0.0708","","","0.1794","0.1949","","","","","","1.089","","","","has coordinates,has disorder","180411","2020-10-21","18:00:00",""
"7208032","16.1787","0.0012","9.8431","0.0005","18.6902","0.0013","90","","114.982","0.002","90","","2697.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H29 Cd Cl2 N2 O8.5 -","- C26 H20 Cd Cl2 N2 O8.5 -","- C104 H80 Cd4 Cl8 N8 O34 -","4","1","","Sun, Jian-Ke; Wang, Peng; Yao, Qing-Xia; Chen, Yong-Juan; Li, Zhao-Hui; Zhang, Yong-Fan; Wu, Li-Ming; Zhang, Jie","Solvent- and anion-controlled photochromism of viologen-based metal‒organic hybrid materials","Journal of Materials Chemistry","2012","22","24","12212","","10.1039/c2jm30558e","","","0.71073","MoKα","","0.0744","0.062","","","0.1763","0.1886","","","","","","1.083","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208033","16.753","0.008","8.84","0.004","18.01","0.009","90","","110.511","0.008","90","","2498","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 Cd I2 N2 O4 -","- C26 H20 Cd I2 N2 O4 -","- C104 H80 Cd4 I8 N8 O16 -","4","1","","Sun, Jian-Ke; Wang, Peng; Yao, Qing-Xia; Chen, Yong-Juan; Li, Zhao-Hui; Zhang, Yong-Fan; Wu, Li-Ming; Zhang, Jie","Solvent- and anion-controlled photochromism of viologen-based metal‒organic hybrid materials","Journal of Materials Chemistry","2012","22","24","12212","","10.1039/c2jm30558e","","","0.71073","MoKα","","0.0503","0.0411","","","0.1116","0.1218","","","","","","1.04","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208034","16.687","0.005","10.02","0.002","17.913","0.005","90","","115.571","0.003","90","","2701.8","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Cd N8 O7 -","- C26 H26 Cd N8 O7 -","- C104 H104 Cd4 N32 O28 -","4","1","","Sun, Jian-Ke; Wang, Peng; Yao, Qing-Xia; Chen, Yong-Juan; Li, Zhao-Hui; Zhang, Yong-Fan; Wu, Li-Ming; Zhang, Jie","Solvent- and anion-controlled photochromism of viologen-based metal‒organic hybrid materials","Journal of Materials Chemistry","2012","22","24","12212","","10.1039/c2jm30558e","","","0.71073","MoKα","","0.0503","0.0388","","","0.1026","0.1101","","","","","","1.106","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208035","16.478","0.006","9.716","0.003","18.084","0.007","90","","114.075","0.004","90","","2643.4","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 Cd N4 O4 S2 -","- C28 H20 Cd N4 O4 S2 -","- C112 H80 Cd4 N16 O16 S8 -","4","1","","Sun, Jian-Ke; Wang, Peng; Yao, Qing-Xia; Chen, Yong-Juan; Li, Zhao-Hui; Zhang, Yong-Fan; Wu, Li-Ming; Zhang, Jie","Solvent- and anion-controlled photochromism of viologen-based metal‒organic hybrid materials","Journal of Materials Chemistry","2012","22","24","12212","","10.1039/c2jm30558e","","","0.71073","MoKα","","0.0695","0.048","","","0.1207","0.1366","","","","","","0.98","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208036","6.02","0.0005","12.7722","0.0011","13.1612","0.0011","118.829","0.001","90.609","0.001","91.687","0.001","885.79","0.13","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H13 N3 O11 Tm -","- C9 H13 N3 O11 Tm -","- C18 H26 N6 O22 Tm2 -","2","1","","Pan, Yingyi; Ma, Deyun; Liu, Huimin; Wu, Hao; He, Dehua; Li, Yingwei","Uncoordinated carbonyl groups of MOFs as anchoring sites for the preparation of highly active Pd nano-catalysts","Journal of Materials Chemistry","2012","22","21","10834","","10.1039/c2jm30867c","","","0.71073","MoKα","","0.0466","0.0402","","","0.0987","0.1036","","","","","","1.048","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208037","5.7875","0.0001","25.372","0.0005","9.6688","0.0002","90","","103.188","0.002","90","","1382.33","0.05","150","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H13 Fe N S -","- C17 H13 Fe N S -","- C68 H52 Fe4 N4 S4 -","4","1","","Kaur, Paramjit; Kaur, Mandeep; Depotter, Griet; Van Cleuvenbergen, Stijn; Asselberghs, Inge; Clays, Koen; Singh, Kamaljit","Thermally stable ferrocenyl “push‒pull” chromophores with tailorable and switchable second-order non-linear optical response: synthesis and structure‒property relationship","Journal of Materials Chemistry","2012","22","21","10597","","10.1039/c2jm31387a","","","0.71073","MoKα","","0.0261","0.0233","","","0.0552","0.0561","","","","","","1.084","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208038","7.3555","0.0004","11.6373","0.0007","11.6538","0.0006","85.685","0.004","81.702","0.004","75.203","0.005","953.6","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H22 Fe N2 -","- C23 H22 Fe N2 -","- C46 H44 Fe2 N4 -","2","1","","Kaur, Paramjit; Kaur, Mandeep; Depotter, Griet; Van Cleuvenbergen, Stijn; Asselberghs, Inge; Clays, Koen; Singh, Kamaljit","Thermally stable ferrocenyl “push‒pull” chromophores with tailorable and switchable second-order non-linear optical response: synthesis and structure‒property relationship","Journal of Materials Chemistry","2012","22","21","10597","","10.1039/c2jm31387a","","","0.71073","MoKα","","0.0477","0.0415","","","0.1419","0.176","","","","","","1.056","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208039","4.9047","0.0019","10.001","0.004","14.952","0.006","80.849","0.005","84.181","0.005","78.46","0.006","707.6","0.5","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","ammonium 3,4,5-trinitro-1H-pyrazol-1-olate ethyl acetate","","- C7 H12 N6 O9 -","- C7 H12 N6 O9 -","- C14 H24 N12 O18 -","2","1","","Zhang, Yanqiang; Parrish, Damon A.; Shreeve, Jean'ne M.","Synthesis and properties of 3,4,5-trinitropyrazole-1-ol and its energetic salts","Journal of Materials Chemistry","2012","22","25","12659","","10.1039/c2jm31535a","","","0.71073","MoKα","","0.0528","0.0441","","","0.1178","0.1243","","","","","","1.056","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208132","2.91081","","2.91081","","10.55029","","90","","90","","120","","77.415","","298","","298","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Potassium Lanthanum Titanate","","- Mg Mo N2 -","- Mg Mo N2 -","- Mg2 Mo2 N4 -","2","0.0833333","","Wang, Liangbiao; Tang, Kaibin; Zhu, Yongchun; Li, Qianwen; Zhu, Baichuan; Wang, LianCheng; Si, Lulu; Qian, Yitai","Solid state synthesis of a new ternary nitride MgMoN2 nanosheets and micromeshes","Journal of Materials Chemistry","2012","22","29","14559","","10.1039/c2jm30844d","powder diffraction","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208133","14.3679","0.001","12.3365","0.0009","27.768","0.002","90","","101.536","0.004","90","","4822.4","0.6","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 O2 -","- C22 H18 O2 -","- C264 H216 O24 -","12","3","","Chien, Ching-Ting; Lin, Chih-Chun; Watanabe, Motonori; Lin, Yan-Duo; Chao, Ting-Han; Chiang, Ta-chung; Huang, Xin-Hua; Wen, Yuh-Sheng; Tu, Chih-Hsin; Sun, Chia-Hsing; Chow, Tahsin J.","Tetracene-based field-effect transistors using solution processes","Journal of Materials Chemistry","2012","22","26","13070","","10.1039/c2jm31134h","","","0.71073","MoKα","","0.1029","0.0515","","","0.1173","0.1477","","","","","","1.008","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208134","8.1278","0.0004","9.4651","0.0004","10.7576","0.0005","102.711","0.002","102.324","0.002","91.986","0.002","785.8","0.06","100","0.1","100","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C22 H18 O2 -","- C22 H18 O2 -","- C44 H36 O4 -","2","1","","Chien, Ching-Ting; Lin, Chih-Chun; Watanabe, Motonori; Lin, Yan-Duo; Chao, Ting-Han; Chiang, Ta-chung; Huang, Xin-Hua; Wen, Yuh-Sheng; Tu, Chih-Hsin; Sun, Chia-Hsing; Chow, Tahsin J.","Tetracene-based field-effect transistors using solution processes","Journal of Materials Chemistry","2012","22","26","13070","","10.1039/c2jm31134h","","","0.71073","MoKα","","0.0432","0.0374","","","0.096","0.1003","","","","","","1.053","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208135","14.9138","0.0013","15.253","0.0012","15.136","0.0014","90","","118.815","0.004","90","","3016.8","0.5","100","0.1","100","0.1","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 -","- C22 H18 -","- C176 H144 -","8","1","","Chien, Ching-Ting; Lin, Chih-Chun; Watanabe, Motonori; Lin, Yan-Duo; Chao, Ting-Han; Chiang, Ta-chung; Huang, Xin-Hua; Wen, Yuh-Sheng; Tu, Chih-Hsin; Sun, Chia-Hsing; Chow, Tahsin J.","Tetracene-based field-effect transistors using solution processes","Journal of Materials Chemistry","2012","22","26","13070","","10.1039/c2jm31134h","","","0.71073","MoKα","","0.0839","0.0609","","","0.1515","0.1648","","","","","","1.066","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208136","5.8708","0.0002","7.6845","0.0003","28.2976","0.0009","90","","90","","90","","1276.62","0.08","200","2","200","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H12 O -","- C19 H12 O -","- C76 H48 O4 -","4","1","","Chien, Ching-Ting; Lin, Chih-Chun; Watanabe, Motonori; Lin, Yan-Duo; Chao, Ting-Han; Chiang, Ta-chung; Huang, Xin-Hua; Wen, Yuh-Sheng; Tu, Chih-Hsin; Sun, Chia-Hsing; Chow, Tahsin J.","Tetracene-based field-effect transistors using solution processes","Journal of Materials Chemistry","2012","22","26","13070","","10.1039/c2jm31134h","","","0.71073","MoKα","","0.0684","0.0389","","","0.0824","0.108","","","","","","1.026","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208137","21.584","0.003","25.772","0.004","40.899","0.004","90","","90","","90","","22751","5","120","","120","","","","","","","","","5","F d d d","-F 2uv 2vw","70","","","","- C129 H151.5 Cl3.5 Ir2 N4 -","- C129.12 H151.6 Cl3.52 Ir2 N4 -","- C1032.96 H1212.8 Cl28.16 Ir16 N32 -","8","","","M'hamedi, Ahmed; Batsanov, Andrei S.; Fox, Mark A.; Bryce, Martin R.; Abdullah, Khalid; Al-Attar, Hameed A.; Monkman, Andrew P.","Dinuclear iridium(iii) complexes of cyclometalated fluorenylpyridine ligands as phosphorescent dopants for efficient solution-processed OLEDs","Journal of Materials Chemistry","2012","22","27","13529","","10.1039/c2jm31143g","","x-ray","0.71073","MoKα","K-L~3~","0.0842","0.0482","","","0.1093","0.1332","","","","","","1.259","","","","has coordinates,has disorder","180412","2020-10-21","18:00:00",""
"7208138","21.975","0.002","25.478","0.002","40.842","0.004","90","","90","","90","","22867","4","120","2","120","","","","","","","","","6","F d d d","-F 2uv 2vw","70","","","","- C129 H147.5 Cl3.5 F4 Ir2 N4 -","- C129 H147.5 Cl3.5 F4 Ir2 N4 -","- C1032 H1180 Cl28 F32 Ir16 N32 -","8","","","M'hamedi, Ahmed; Batsanov, Andrei S.; Fox, Mark A.; Bryce, Martin R.; Abdullah, Khalid; Al-Attar, Hameed A.; Monkman, Andrew P.","Dinuclear iridium(iii) complexes of cyclometalated fluorenylpyridine ligands as phosphorescent dopants for efficient solution-processed OLEDs","Journal of Materials Chemistry","2012","22","27","13529","","10.1039/c2jm31143g","","x-ray","0.71073","MoKα","K-L~3~","0.1293","0.0514","","","0.1111","0.1385","","","","","","1.443","","","","has coordinates,has disorder","180412","2020-10-21","18:00:00",""
"7208139","16.2668","0.0008","19.4756","0.0009","22.8218","0.0011","105.98","0.006","101.103","0.006","91.648","0.007","6794.9","0.6","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C151 H198 Cl4 Ir2 N4 O4 -","- C150.75 H186 Cl4 Ir2 N4 O4 -","- C301.5 H372 Cl8 Ir4 N8 O8 -","2","1","","M'hamedi, Ahmed; Batsanov, Andrei S.; Fox, Mark A.; Bryce, Martin R.; Abdullah, Khalid; Al-Attar, Hameed A.; Monkman, Andrew P.","Dinuclear iridium(iii) complexes of cyclometalated fluorenylpyridine ligands as phosphorescent dopants for efficient solution-processed OLEDs","Journal of Materials Chemistry","2012","22","27","13529","","10.1039/c2jm31143g","","x-ray","0.71073","MoKα","K-L~3~","0.0519","0.0324","","","0.0788","0.0888","","","","","","1.029","","","","has coordinates,has disorder","180412","2020-10-21","18:00:00",""
"7208140","12.4152","0.0005","24.9244","0.0012","16.7445","0.0005","90","","91.503","0.011","90","","5179.7","0.4","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C122 H144 Ir2 N6 O2 -","- C122 H144 Ir2 N6 O2 -","- C244 H288 Ir4 N12 O4 -","2","1","","M'hamedi, Ahmed; Batsanov, Andrei S.; Fox, Mark A.; Bryce, Martin R.; Abdullah, Khalid; Al-Attar, Hameed A.; Monkman, Andrew P.","Dinuclear iridium(iii) complexes of cyclometalated fluorenylpyridine ligands as phosphorescent dopants for efficient solution-processed OLEDs","Journal of Materials Chemistry","2012","22","27","13529","","10.1039/c2jm31143g","","","0.71073","MoKα","","0.0954","0.051","","","0.1093","0.1337","","","","","","0.664","","","","has coordinates,has disorder","180412","2020-10-21","18:00:00",""
"7208141","12.5082","0.0007","24.97","0.0013","16.8684","0.001","90","","91.23","0.03","90","","5267.3","0.5","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C122 H140 F4 Ir2 N6 O2 -","- C122 H138 F4 Ir2 N6 O2 -","- C244 H276 F8 Ir4 N12 O4 -","2","1","","M'hamedi, Ahmed; Batsanov, Andrei S.; Fox, Mark A.; Bryce, Martin R.; Abdullah, Khalid; Al-Attar, Hameed A.; Monkman, Andrew P.","Dinuclear iridium(iii) complexes of cyclometalated fluorenylpyridine ligands as phosphorescent dopants for efficient solution-processed OLEDs","Journal of Materials Chemistry","2012","22","27","13529","","10.1039/c2jm31143g","","","0.71073","MoKα","","0.0429","0.0339","","","0.0729","0.0767","","","","","","1.051","","","","has coordinates,has disorder","180412","2020-10-21","18:00:00",""
"7208142","12.11","0.003","16.493","0.004","21.339","0.005","82.45","0.03","89.83","0.03","81.81","0.03","4181.5","1.8","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C98 H126 Ir N3 O3 -","- C95.24 H114 Ir N3 O3 -","- C190.48 H228 Ir2 N6 O6 -","2","1","","M'hamedi, Ahmed; Batsanov, Andrei S.; Fox, Mark A.; Bryce, Martin R.; Abdullah, Khalid; Al-Attar, Hameed A.; Monkman, Andrew P.","Dinuclear iridium(iii) complexes of cyclometalated fluorenylpyridine ligands as phosphorescent dopants for efficient solution-processed OLEDs","Journal of Materials Chemistry","2012","22","27","13529","","10.1039/c2jm31143g","","x-ray","0.71073","MoKα","K-L~3~","0.1354","0.0688","","","0.1354","0.1558","","","","","","0.884","","","","has coordinates,has disorder","180412","2020-10-21","18:00:00",""
"7208143","10.1895","0.001","11.4764","0.0016","17.763","0.003","102.487","0.005","96.931","0.008","101.36","0.008","1959.2","0.5","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H21 N O -","- C27 H21 N O -","- C108 H84 N4 O4 -","4","2","","Holliman, Peter J.; Mohsen, Moneer; Connell, Arthur; Davies, Matthew L.; Al-Salihi, Kareem; Pitak, Mateusz B.; Tizzard, Graham J.; Coles, Simon J.; Harrington, Ross W.; Clegg, William; Serpa, Carlos; Fontes, Octávio H.; Charbonneau, Cecile; Carnie, Matthew J.","Ultra-fast co-sensitization and tri-sensitization of dye-sensitized solar cells with N719, SQ1 and triarylamine dyes","Journal of Materials Chemistry","2012","22","26","13318","","10.1039/c2jm31314f","","","0.71073","MoKα","","0.1911","0.1076","","","0.2051","0.243","","","","","","1.074","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208144","11.2472","0.0004","13.4462","0.0004","30.0363","0.0011","90","","90.567","0.001","90","","4542.2","0.3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H25 N O2 -","- C29 H25 N O2 -","- C232 H200 N8 O16 -","8","2","","Holliman, Peter J.; Mohsen, Moneer; Connell, Arthur; Davies, Matthew L.; Al-Salihi, Kareem; Pitak, Mateusz B.; Tizzard, Graham J.; Coles, Simon J.; Harrington, Ross W.; Clegg, William; Serpa, Carlos; Fontes, Octávio H.; Charbonneau, Cecile; Carnie, Matthew J.","Ultra-fast co-sensitization and tri-sensitization of dye-sensitized solar cells with N719, SQ1 and triarylamine dyes","Journal of Materials Chemistry","2012","22","26","13318","","10.1039/c2jm31314f","","","0.71073","MoKα","","0.1307","0.0843","","","0.1386","0.1605","","","","","","1.167","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208145","17.1248","0.0005","9.6815","0.0002","12.9988","0.0003","90","","110.727","0.002","90","","2015.63","0.09","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H21 N O2 -","- C27 H21 N O2 -","- C108 H84 N4 O8 -","4","1","","Holliman, Peter J.; Mohsen, Moneer; Connell, Arthur; Davies, Matthew L.; Al-Salihi, Kareem; Pitak, Mateusz B.; Tizzard, Graham J.; Coles, Simon J.; Harrington, Ross W.; Clegg, William; Serpa, Carlos; Fontes, Octávio H.; Charbonneau, Cecile; Carnie, Matthew J.","Ultra-fast co-sensitization and tri-sensitization of dye-sensitized solar cells with N719, SQ1 and triarylamine dyes","Journal of Materials Chemistry","2012","22","26","13318","","10.1039/c2jm31314f","","","0.71073","MoKα","","0.0684","0.0482","","","0.1038","0.1141","","","","","","1.052","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208146","10","0.002","18.679","0.004","15.789","0.004","90","","91.675","0.002","90","","2948","1.1","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 N -","- C20 H17 N -","- C160 H136 N8 -","8","2","","Holliman, Peter J.; Mohsen, Moneer; Connell, Arthur; Davies, Matthew L.; Al-Salihi, Kareem; Pitak, Mateusz B.; Tizzard, Graham J.; Coles, Simon J.; Harrington, Ross W.; Clegg, William; Serpa, Carlos; Fontes, Octávio H.; Charbonneau, Cecile; Carnie, Matthew J.","Ultra-fast co-sensitization and tri-sensitization of dye-sensitized solar cells with N719, SQ1 and triarylamine dyes","Journal of Materials Chemistry","2012","22","26","13318","","10.1039/c2jm31314f","","","0.6889","synchrotron","","0.0732","0.0584","","","0.1633","0.1707","","","","","","1.094","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208147","7.3261","0.0002","29.785","0.0009","9.8773","0.0003","90","","109.281","0.0016","90","","2034.41","0.11","120","","120","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C26 H23 N4 O -","- C26 H23 N4 O -","- C104 H92 N16 O4 -","4","1","","Borozdina, Yulia B.; Kamm, Valentin; Laquai, Frédéric; Baumgarten, Martin","Tuning the sensitivity of fluorophore‒nitroxide radicals","Journal of Materials Chemistry","2012","22","26","13260","","10.1039/c2jm31390a","","","0.71073","MoKα","","0.0968","0.0508","","0.0672","0.0627","0.0627","","","","","","1.0905","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208148","7.4598","0.0002","29.3972","0.0009","10.0132","0.0003","90","","109.821","0.0016","90","","2065.78","0.11","120","","120","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C26 H23 N4 O2 -","- C26 H23 N4 O2 -","- C104 H92 N16 O8 -","4","1","","Borozdina, Yulia B.; Kamm, Valentin; Laquai, Frédéric; Baumgarten, Martin","Tuning the sensitivity of fluorophore‒nitroxide radicals","Journal of Materials Chemistry","2012","22","26","13260","","10.1039/c2jm31390a","","","0.71073","MoKα","","0.0651","0.0447","","0.0589","0.0561","0.0561","","","","","","1.0804","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208149","11.9981","0.0019","7.3161","0.0012","23.079","0.003","90","","90","","90","","2025.9","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H11 Cl N2 O -","- C10 H11 Cl N2 O -","- C80 H88 Cl8 N16 O8 -","8","1","","Sánchez, Ignacio; Campo, José Antonio; Heras, José Vicente; Rosario Torres, M.; Cano, Mercedes","Pyrazolium salts as a new class of ionic liquid crystals","Journal of Materials Chemistry","2012","22","26","13239","","10.1039/c2jm31939j","","","0.71073","MoKα","","0.135","0.0428","","","0.0823","0.1024","","","","","","0.971","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208150","6.162","0.0006","9.223","0.0009","19.067","0.0019","93.895","0.002","94.406","0.002","104.332","0.002","1042.54","0.18","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H29 B F4 N2 O -","- C19 H29 B F4 N2 O -","- C38 H58 B2 F8 N4 O2 -","2","1","","Sánchez, Ignacio; Campo, José Antonio; Heras, José Vicente; Rosario Torres, M.; Cano, Mercedes","Pyrazolium salts as a new class of ionic liquid crystals","Journal of Materials Chemistry","2012","22","26","13239","","10.1039/c2jm31939j","","","0.71073","MoKα","","0.1172","0.0619","","","0.1841","0.2181","","","","","","0.994","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208151","4.9991","0.0004","9.5975","0.0008","24.98","0.002","90","","90","","90","","1198.51","0.17","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H11 N2 O5 Re -","- C10 H11 N2 O5 Re -","- C40 H44 N8 O20 Re4 -","4","1","","Sánchez, Ignacio; Campo, José Antonio; Heras, José Vicente; Rosario Torres, M.; Cano, Mercedes","Pyrazolium salts as a new class of ionic liquid crystals","Journal of Materials Chemistry","2012","22","26","13239","","10.1039/c2jm31939j","","","0.71073","MoKα","","0.0219","0.0199","","","0.0467","0.0475","","","","","","0.996","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208152","6.344","0.004","10.275","0.006","11.844","0.007","70.91","0.01","83.266","0.012","89.319","0.012","724.3","0.8","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H11 F3 N2 O4 S -","- C11 H11 F3 N2 O4 S -","- C22 H22 F6 N4 O8 S2 -","2","1","","Sánchez, Ignacio; Campo, José Antonio; Heras, José Vicente; Rosario Torres, M.; Cano, Mercedes","Pyrazolium salts as a new class of ionic liquid crystals","Journal of Materials Chemistry","2012","22","26","13239","","10.1039/c2jm31939j","","","0.71073","MoKα","","0.1514","0.0641","","","0.14","0.1681","","","","","","0.979","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208153","9.9935","0.0018","14.007","0.003","18.935","0.003","103.999","0.004","91.508","0.004","96.957","0.004","2548.6","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H18 N2 O4 S -","- C17 H18 N2 O4 S -","- C102 H108 N12 O24 S6 -","6","3","","Sánchez, Ignacio; Campo, José Antonio; Heras, José Vicente; Rosario Torres, M.; Cano, Mercedes","Pyrazolium salts as a new class of ionic liquid crystals","Journal of Materials Chemistry","2012","22","26","13239","","10.1039/c2jm31939j","","","0.71073","MoKα","","0.2109","0.0614","","","0.0913","0.1153","","","","","","0.922","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208154","15.48852","0.00016","15.48852","0.00016","15.48852","0.00016","90","","90","","90","","3715.61","0.07","298","","298","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","","","- Ca15 N30 O10 Si20 -","- Ca15 N30 O9.99996 Si20 -","- Ca60 N120 O39.9998 Si80 -","4","0.166667","","Park, Woon Bae; Singh, Satendra Pal; Yoon, Chulsoo; Sohn, Kee-Sun","Eu2+ luminescence from 5 different crystallographic sites in a novel red phosphor, Ca15Si20O10N30:Eu2+","Journal of Materials Chemistry","2012","22","28","14068","","10.1039/c2jm32032k","powder diffraction","","1.5406","CuKα","","","","","","","","","4.4607","","","","","","","","has coordinates","180412","2020-10-21","18:00:00",""
"7208411","8.8902","0.0003","38.4841","0.0012","10.2135","0.0003","90","","103.613","0.001","90","","3396.19","0.19","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 N4 O12 S4 -","- C28 H40 N4 O12 S4 -","- C112 H160 N16 O48 S16 -","4","1","","Delahaye, Emilie; Göbel, Ronald; Löbbicke, Ruben; Guillot, Régis; Sieber, Christoph; Taubert, Andreas","Silica ionogels for proton transport","Journal of Materials Chemistry","2012","22","33","17140","","10.1039/c2jm00037g","","x-ray","0.71073","MoKα","","0.0729","0.0433","","","0.0971","0.11","","","","","","1.011","","","","has coordinates,has disorder","180415","2020-10-21","18:00:00",""
"7208412","19.346","0.002","24.081","0.003","14.2543","0.0015","90","","90","","90","","6640.7","1.3","273","2","273","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C10 H4 Ca N3 O5 -","- C10 H4 Ca N3 O5 -","- C160 H64 Ca16 N48 O80 -","16","","","Mallick, Arijit; Schön, Eva-Maria; Panda, Tamas; Sreenivas, K.; Díaz, David Díaz; Banerjee, Rahul","Fine-tuning the balance between crystallization and gelation and enhancement of CO2 uptake on functionalized calcium based MOFs and metallogels","Journal of Materials Chemistry","2012","22","30","14951","","10.1039/c2jm30866e","","","0.71073","MoKα","","0.0642","0.0567","","","0.1671","0.1728","","","","","","1.083","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208413","10.242","0.005","19.254","0.009","24.7","0.012","84.455","0.007","79.483","0.008","89.85","0.007","4766","4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C51.5 H55 Fe N6 O3 Se3 -","- C51.5 H55 Fe N6 O3 Se3 -","- C206 H220 Fe4 N24 O12 Se12 -","4","2","","Akhtar, Masood; Akhtar, Javeed; Malik, Mohammad Azad; Tuna, Floriana; Helliwell, Madeleine; O'Brien, Paul","Deposition of iron selenide nanocrystals and thin films from tris(N,N-diethyl-N′-naphthoylselenoureato)iron(iii)","Journal of Materials Chemistry","2012","22","30","14970","","10.1039/c2jm31291c","","","0.71073","MoKα","","0.1218","0.1038","","","0.2402","0.249","","","","","","1.115","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208414","10.6549","0.0012","14.5638","0.0016","16.0435","0.0017","99.783","0.002","102.396","0.002","101.834","0.002","2319.5","0.4","571","2","571","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H26 N2 O9 Zn1.5 -","- C32 H26 N2 O9 Zn1.5 -","- C64 H52 N4 O18 Zn3 -","2","1","","Guo, Min; Sun, Zhong-Ming","Solvents control over the degree of interpenetration in metal-organic frameworks and their high sensitivities for detecting nitrobenzene at ppm level","Journal of Materials Chemistry","2012","22","31","15939","","10.1039/c2jm32066e","","","0.71073","MoKα","","0.1274","0.0931","","","0.2923","0.3245","","","","","","1.153","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208415","8.981","0.0005","12.2471","0.0007","15.8888","0.0009","76.827","0.001","75.953","0.001","79.384","0.001","1635.31","0.16","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H26 N2 O9 Zn1.5 -","- C32 H26 N2 O9 Zn1.5 -","- C64 H52 N4 O18 Zn3 -","2","1","","Guo, Min; Sun, Zhong-Ming","Solvents control over the degree of interpenetration in metal-organic frameworks and their high sensitivities for detecting nitrobenzene at ppm level","Journal of Materials Chemistry","2012","22","31","15939","","10.1039/c2jm32066e","","","0.71073","MoKα","","0.0776","0.0636","","","0.1955","0.2114","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208416","11.9556","0.001","5.7003","0.0004","15.8568","0.0019","90","","119.774","0.007","90","","937.99","0.17","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","bis(acetonitrile)bis(acetylacetonato)vanadium(III) tetrafluoroborate","bis(acetonitrile)bis(acetylacetonato)vanadium(III) tetrafluoroborate","","- C14 H20 B F4 N2 O4 V -","- C14 H20 B F4 N2 O4 V -","- C28 H40 B2 F8 N4 O8 V2 -","2","0.5","","Kohl, Julia; Wiedemann, Dennis; Nakhal, Suliman; Bottke, Patrick; Ferro, Noel; Bredow, Thomas; Kemnitz, Erhard; Wilkening, Martin; Heitjans, Paul; Lerch, Martin","Synthesis of ternary transition metal fluorides Li3MF6via a sol‒gel route as candidates for cathode materials in lithium-ion batteries","Journal of Materials Chemistry","2012","22","31","15819","","10.1039/c2jm32133e","","x-ray","0.71073","MoKα","","0.0633","0.045","","","0.1044","0.1093","","","","","","0.98","","","","has coordinates,has disorder","180415","2020-10-21","18:00:00",""
"7208417","29.187","0.004","13.3717","0.0018","15.048","0.002","90","","109.333","0.002","90","","5541.8","1.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 Br2 N2 O2 Pt -","- C28 H34 Br2 N2 O2 Pt -","- C224 H272 Br16 N16 O16 Pt8 -","8","1","","Zhang, Jie; Zhao, Fangchao; Zhu, Xunjin; Wong, Wai-Kwok; Ma, Dongge; Wong, Wai-Yeung","New phosphorescent platinum(ii) Schiff base complexes for PHOLED applications","Journal of Materials Chemistry","2012","22","32","16448","","10.1039/c2jm32266h","","","0.71073","MoKα","","0.0461","0.0417","","","0.1052","0.1076","","","","","","1.069","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208418","22.369","0.005","8.74","0.005","8.395","0.005","90","0.005","94.859","0.005","90","0.005","1635.4","1.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H50 N4 O8 -","- C34 H50 N4 O8 -","- C68 H100 N8 O16 -","2","0.5","","Yu, Zhipeng; Duan, Yaya; Cheng, Longhuai; Han, Zhili; Zheng, Zheng; Zhou, Hongping; Wu, Jieying; Tian, Yupeng","Aggregation induced emission in the rotatable molecules: the essential role of molecular interaction","Journal of Materials Chemistry","2012","22","33","16927","","10.1039/c2jm32405a","","","0.71069","MoKα","","0.038","0.0363","","","0.1356","0.1398","","","","","","1.259","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208419","20.005","0.005","7.828","0.005","20.366","0.005","90","0.005","102.714","0.005","90","0.005","3111","2","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C33 H45 N6 -","- C33 H45 N6 -","- C132 H180 N24 -","4","1","","Yu, Zhipeng; Duan, Yaya; Cheng, Longhuai; Han, Zhili; Zheng, Zheng; Zhou, Hongping; Wu, Jieying; Tian, Yupeng","Aggregation induced emission in the rotatable molecules: the essential role of molecular interaction","Journal of Materials Chemistry","2012","22","33","16927","","10.1039/c2jm32405a","","","0.71069","MoKα","","0.0838","0.0533","","","0.1378","0.1728","","","","","","0.862","","","","has coordinates,has disorder","180415","2020-10-21","18:00:00",""
"7208420","9.189","0.003","11.486","0.004","17.918","0.006","80.253","0.006","81.343","0.005","86.819","0.005","1841.7","1.1","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H32 La N O13 -","- C35 H32 La N O13 -","- C70 H64 La2 N2 O26 -","2","1","","Dang, Song; Ma, En; Sun, Zhong-Ming; Zhang, Hongjie","A layer-structured Eu-MOF as a highly selective fluorescent probe for Fe3+ detection through a cation-exchange approach","Journal of Materials Chemistry","2012","22","33","16920","","10.1039/c2jm32661b","","","0.71073","MoKα","","0.0582","0.0481","","","0.1374","0.1481","","","","","","1.076","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208421","9.3193","0.0011","11.8459","0.0014","17.601","0.002","82.597","0.002","82.102","0.002","87.194","0.002","1907.6","0.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H32 N O13 Y -","- C35 H34 N O13 Y -","- C70 H68 N2 O26 Y2 -","2","1","","Dang, Song; Ma, En; Sun, Zhong-Ming; Zhang, Hongjie","A layer-structured Eu-MOF as a highly selective fluorescent probe for Fe3+ detection through a cation-exchange approach","Journal of Materials Chemistry","2012","22","33","16920","","10.1039/c2jm32661b","","","0.71073","MoKα","","0.1182","0.071","","","0.2108","0.2436","","","","","","1.05","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208422","4.5346","0.0013","13.251","0.004","22.712","0.006","90","","90.203","0.005","90","","1364.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 I6 N2 O2 Pb2 -","- C12 H18 I6 N2 O2 Pb2 -","- C24 H36 I12 N4 O4 Pb4 -","2","0.5","","Wang, Guan-E; Xu, Gang; Wang, Ming-Sheng; Sun, Jing; Xu, Zhong-Ning; Guo, Guo-Cong; Huang, Jin-Shun","A novel inorganic‒organic hybrid for detection of nitrite anions with extremely high sensitivity and selectivity","Journal of Materials Chemistry","2012","22","33","16742","","10.1039/c2jm32830e","","","0.71073","MoKα","","0.0685","0.0422","","","0.0738","0.0767","","","","","","1.021","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208423","11.4398","0.0002","13.2955","0.0002","26.2483","0.0004","90","","90","","90","","3992.31","0.11","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H42 Co2 N8 O11 -","- C36 H42 Co2 N8 O11 -","- C144 H168 Co8 N32 O44 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0369","0.0289","","","0.0679","0.0691","","","","","","1.003","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208424","11.3503","0.0003","13.1581","0.0003","26.213","0.0006","90","","90","","90","","3914.87","0.16","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H18 Co2 N4 O9 -","- C24 H18 Co2 N4 O9 -","- C96 H72 Co8 N16 O36 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0567","0.0479","","","0.1572","0.1624","","","","","","1.173","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208425","11.249","0.004","13.238","0.004","26.05","0.009","90","","90","","90","","3879","2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H24 Co2 N6 O9 -","- C28 H24 Co2 N6 O9 -","- C112 H96 Co8 N24 O36 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0954","0.0856","","","0.2186","0.2343","","","","","","1.174","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208426","11.3749","0.0004","13.3596","0.0005","25.9691","0.0011","90","","90","","90","","3946.4","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H30 Co2 N4 O9 -","- C30 H30 Co2 N4 O9 -","- C120 H120 Co8 N16 O36 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0509","0.046","","","0.1375","0.1433","","","","","","1.144","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208427","11.379","0.003","13.386","0.004","25.904","0.008","90","","90","","90","","3946","2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H18 Co2 N4 O10 -","- C32 H18 Co2 N4 O10 -","- C128 H72 Co8 N16 O40 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0743","0.0671","","","0.1995","0.2176","","","","","","1.056","","","","has coordinates,has disorder","180415","2020-10-21","18:00:00",""
"7208428","11.269","0.0017","13.382","0.002","25.592","0.004","90","","90","","90","","3859.3","1","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H23 Co2 N4 O9.5 -","- C26 H23 Co2 N4 O9.5 -","- C104 H92 Co8 N16 O38 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0338","0.0326","","","0.1043","0.1052","","","","","","1.112","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208429","11.4777","0.0002","13.3164","0.0003","26.0307","0.0004","90","","90","","90","","3978.57","0.13","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H28 Co2 N4 O10 -","- C32 H28 Co2 N4 O10 -","- C128 H112 Co8 N16 O40 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0532","0.0479","","","0.1665","0.1725","","","","","","1.178","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208430","11.4659","0.0003","13.2732","0.0003","26.1201","0.0012","90","","90","","90","","3975.2","0.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H28 Co2 N4 O10 -","- C32 H28 Co2 N4 O10 -","- C128 H112 Co8 N16 O40 -","4","1","","Zhang, Hai-Xia; Wang, Fei; Tan, Yan-Xi; Kang, Yao; Zhang, Jian","Homochiral porous metal‒organic frameworks containing only achiral building blocks for enantioselective separation","Journal of Materials Chemistry","2012","22","32","16288","","10.1039/c2jm33269h","","","0.71073","MoKα","","0.0737","0.0567","","","0.1789","0.1964","","","","","","1.156","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208431","19.822","0.007","20.141","0.007","6.596","0.003","90","","102.289","0.005","90","","2573","1.7","153","","153","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H22 Ge S2 -","- C32 H22 Ge S2 -","- C128 H88 Ge4 S8 -","4","0.5","","Kondo, Ryosuke; Yasuda, Takuma; Yang, Yu Seok; Kim, Jun Yun; Adachi, Chihaya","Highly luminescent π-conjugated dithienometalloles: photophysical properties and their application in organic light-emitting diodes","Journal of Materials Chemistry","2012","22","33","16810","","10.1039/c2jm33526c","","","0.71075","MoKα","","","0.0439","","","","0.1065","","","","","","1","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208432","19.549","0.007","19.718","0.006","6.618","0.002","90","","101.413","0.005","90","","2500.6","1.4","93","","93","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H22 S2 Si -","- C32 H22 S2 Si -","- C128 H88 S8 Si4 -","4","0.5","","Kondo, Ryosuke; Yasuda, Takuma; Yang, Yu Seok; Kim, Jun Yun; Adachi, Chihaya","Highly luminescent π-conjugated dithienometalloles: photophysical properties and their application in organic light-emitting diodes","Journal of Materials Chemistry","2012","22","33","16810","","10.1039/c2jm33526c","","","0.71075","MoKα","","","0.0312","","","","0.0879","","","","","","1.083","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208433","16.192","0.003","15.167","0.003","13.658","0.003","90","","96.209","0.003","90","","3334.5","1.2","93","","93","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 O2 S3 -","- C20 H12 O2 S3 -","- C160 H96 O16 S24 -","8","1","","Kondo, Ryosuke; Yasuda, Takuma; Yang, Yu Seok; Kim, Jun Yun; Adachi, Chihaya","Highly luminescent π-conjugated dithienometalloles: photophysical properties and their application in organic light-emitting diodes","Journal of Materials Chemistry","2012","22","33","16810","","10.1039/c2jm33526c","","","0.71075","MoKα","","","0.0506","","","","0.1299","","","","","","1.171","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208608","5.9295","0.001","5.9295","0.001","20.79","0.004","90","","90","","120","","633.03","0.19","293","","293","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- Ba Cu3 H2 O10 V2 -","- Ba Cu3 H3.9996 O9.9998 V1.9998 -","- Ba3 Cu9 H11.9988 O29.9994 V5.9994 -","3","0.0833333","","Yoshida, Hiroyuki; Michiue, Yuichi; Takayama-Muromachi, Eiji; Isobe, Masaaki","β-Vesignieite BaCu3V2O8(OH)2: a structurally perfect S = 1/2 kagomé antiferromagnet","Journal of Materials Chemistry","2012","22","36","18793","","10.1039/c2jm32250a","","x-ray","0.71069","MoKα","","0.0381","0.0217","","","0.0322","0.0337","","","","1.83","1.83","1.69","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208609","24.757","0.004","7.1588","0.0013","19.353","0.004","90","","108.455","0.007","90","","3253.5","1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H12 La O9 P3 -","- C9 H12 La O9 P3 -","- C72 H96 La8 O72 P24 -","8","1","","Vilela, Sérgio M. F.; Ananias, Duarte; Gomes, Ana C.; Valente, Anabela A.; Carlos, Luís D.; Cavaleiro, José A. S.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Multi-functional metal‒organic frameworks assembled from a tripodal organic linker","Journal of Materials Chemistry","2012","22","35","18354","","10.1039/c2jm32501b","","","0.71073","MoKα","","0.0229","0.0208","","","0.051","0.052","","","","","","1.107","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208610","23.5921","0.0006","7.2774","0.0002","19.7125","0.0005","90","","106.176","0.001","90","","3250.43","0.15","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 La2 O21 P6 -","- C18 H28 La2 O21 P6 -","- C72 H112 La8 O84 P24 -","4","0.5","","Vilela, Sérgio M. F.; Ananias, Duarte; Gomes, Ana C.; Valente, Anabela A.; Carlos, Luís D.; Cavaleiro, José A. S.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Multi-functional metal‒organic frameworks assembled from a tripodal organic linker","Journal of Materials Chemistry","2012","22","35","18354","","10.1039/c2jm32501b","","","0.71073","MoKα","","0.031","0.0226","","","0.0501","0.0535","","","","","","1.035","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208611","23.3599","0.0013","7.2198","0.0004","19.7793","0.0011","90","","106.034","0.002","90","","3206.1","0.3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 Ce2 O21 P6 -","- C18 H28 Ce2 O21 P6 -","- C72 H112 Ce8 O84 P24 -","4","0.5","","Vilela, Sérgio M. F.; Ananias, Duarte; Gomes, Ana C.; Valente, Anabela A.; Carlos, Luís D.; Cavaleiro, José A. S.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Multi-functional metal‒organic frameworks assembled from a tripodal organic linker","Journal of Materials Chemistry","2012","22","35","18354","","10.1039/c2jm32501b","","","0.71073","MoKα","","0.0307","0.0226","","","0.0462","0.0486","","","","","","1.04","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208612","23.368","0.004","7.204","0.0011","19.745","0.003","90","","106.262","0.007","90","","3190.9","0.9","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 O21 P6 Pr2 -","- C18 H24 O21 P6 Pr2 -","- C72 H96 O84 P24 Pr8 -","4","0.5","","Vilela, Sérgio M. F.; Ananias, Duarte; Gomes, Ana C.; Valente, Anabela A.; Carlos, Luís D.; Cavaleiro, José A. S.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Multi-functional metal‒organic frameworks assembled from a tripodal organic linker","Journal of Materials Chemistry","2012","22","35","18354","","10.1039/c2jm32501b","","","0.71073","MoKα","","0.0998","0.0497","","","0.1043","0.1213","","","","","","0.974","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208613","23.419","0.005","7.1793","0.0016","19.697","0.004","90","","106.65","0.014","90","","3172.8","1.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 Nd2 O21 P6 -","- C18 H28 Nd2 O21 P6 -","- C72 H112 Nd8 O84 P24 -","4","0.5","","Vilela, Sérgio M. F.; Ananias, Duarte; Gomes, Ana C.; Valente, Anabela A.; Carlos, Luís D.; Cavaleiro, José A. S.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Multi-functional metal‒organic frameworks assembled from a tripodal organic linker","Journal of Materials Chemistry","2012","22","35","18354","","10.1039/c2jm32501b","","","0.71073","MoKα","","0.0974","0.0466","","","0.0703","0.081","","","","","","0.981","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208614","27.108","0.005","17.406","0.004","17.248","0.003","90","","90","","90","","8138","3","93","2","93","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C24 H56 Ba2 N4 O24 -","- C24 H56 Ba2 N4 O24 -","- C192 H448 Ba16 N32 O192 -","8","2","","Fu, Da-Wei; Zhang, Yi; Cai, Hong-Ling; Zhu, Hao-miao; Chen, Xue-yuan; Xiong, Ren-Gen","The first example of a molecule-based ferroelectric with barium cation: catena-(μ2-nitrito-O,O)-bi-aqua-(18-crown-6)-barium nitrite","Journal of Materials Chemistry","2012","22","34","17525","","10.1039/c2jm32662k","","","0.71073","MoKα","","0.0278","0.025","","","0.0607","0.0671","","","","","","1.143","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208615","17.573","0.004","17.51","0.004","6.8305","0.0014","90","","90","","90","","2101.8","0.8","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H28 Ba N2 O12 -","- C12 H28 Ba N2 O12 -","- C48 H112 Ba4 N8 O48 -","4","0.5","","Fu, Da-Wei; Zhang, Yi; Cai, Hong-Ling; Zhu, Hao-miao; Chen, Xue-yuan; Xiong, Ren-Gen","The first example of a molecule-based ferroelectric with barium cation: catena-(μ2-nitrito-O,O)-bi-aqua-(18-crown-6)-barium nitrite","Journal of Materials Chemistry","2012","22","34","17525","","10.1039/c2jm32662k","","","0.71073","MoKα","","0.0737","0.058","","","0.142","0.1541","","","","","","1.144","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208616","10.292","0.004","7.552","0.003","12.557","0.005","90","","90.007","0.004","90","","976","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- O13 P2 Pb V2 -","- O13 P2 Pb V2 -","- O52 P8 Pb4 V8 -","4","1","","Chen, Yan; Liu, Tao; He, Cheng; Duan, Chunying","Mild hydrothermal synthesis, structure and characterization of the vanadyl phosphate hydrate Pb(VOPO4)2·3H2O: the formation of spin dimers in a three dimensional crystal structure","Journal of Materials Chemistry","2012","22","37","19872","","10.1039/c2jm32976j","","","0.71073","MoKα","","0.0366","0.0316","","","0.07","0.0722","","","","","","1.044","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208617","9.7136","0.0019","13.824","0.003","11.003","0.002","90","","90","","90","","1477.5","0.5","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- O18 P3 Pb3 V3 -","- O18 P3 Pb3 V3 -","- O72 P12 Pb12 V12 -","4","0.5","","Chen, Yan; Liu, Tao; He, Cheng; Duan, Chunying","Mild hydrothermal synthesis, structure and characterization of the vanadyl phosphate hydrate Pb(VOPO4)2·3H2O: the formation of spin dimers in a three dimensional crystal structure","Journal of Materials Chemistry","2012","22","37","19872","","10.1039/c2jm32976j","","","0.71073","MoKα","","0.0545","0.0385","","","0.0801","0.0866","","","","","","1.114","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208618","7.992","0.009","15.777","0.016","3.494","0.004","90","","100.22","0.02","90","","433.6","0.8","293","2","293","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Cd4 Gd O10 -","- B3 Cd4 Gd O10 -","- B6 Cd8 Gd2 O20 -","2","0.5","","Zou, Guohong; Ma, Zuju; Wu, Kechen; Ye, Ning","Cadmium-rare earth oxyborates Cd4ReO(BO3)3 (Re = Y, Gd, Lu): congruently melting compounds with large SHG responses","Journal of Materials Chemistry","2012","22","37","19911","","10.1039/c2jm33029f","","","0.71073","MoKα","","0.0392","0.0383","","","0.0928","0.0932","","","","","","1.098","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208619","7.937","0.005","15.778","0.01","3.436","0.002","90","","99.972","0.01","90","","423.8","0.5","293","2","293","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Cd4 Lu O10 -","- B3 Cd4 Lu O10 -","- B6 Cd8 Lu2 O20 -","2","0.5","","Zou, Guohong; Ma, Zuju; Wu, Kechen; Ye, Ning","Cadmium-rare earth oxyborates Cd4ReO(BO3)3 (Re = Y, Gd, Lu): congruently melting compounds with large SHG responses","Journal of Materials Chemistry","2012","22","37","19911","","10.1039/c2jm33029f","","","0.71073","MoKα","","0.0529","0.0509","","","0.1298","0.1311","","","","","","1.032","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208620","7.9627","0.001","15.793","0.002","3.4706","0.0004","90","","100.088","0.007","90","","429.7","0.09","293","2","293","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Cd4 O10 Y -","- B3 Cd4 O10 Y -","- B6 Cd8 O20 Y2 -","2","0.5","","Zou, Guohong; Ma, Zuju; Wu, Kechen; Ye, Ning","Cadmium-rare earth oxyborates Cd4ReO(BO3)3 (Re = Y, Gd, Lu): congruently melting compounds with large SHG responses","Journal of Materials Chemistry","2012","22","37","19911","","10.1039/c2jm33029f","","","0.71073","MoKα","","0.0439","0.0434","","","0.1027","0.103","","","","","","1.015","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208621","8.511","0.0015","14.954","0.003","8.4748","0.0015","90","","104.292","0.012","90","","1045.2","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N2 O2 -","- C26 H20 N2 O2 -","- C52 H40 N4 O4 -","2","0.5","","Xu, Zhenzhen; Liao, Qing; Wu, Yishi; Ren, Wenlu; Li, Wei; Liu, Libing; Wang, Shu; Gu, Zhanjun; Zhang, Haoli; Fu, Hongbing","Water-miscible organic J-aggregate nanoparticles as efficient two-photon fluorescent nano-probes for bio-imaging","Journal of Materials Chemistry","2012","22","34","17737","","10.1039/c2jm33081d","","","1.54186","CuKα","","0.0693","0.049","","","0.1121","0.1224","","","","","","1.081","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208622","12.764","0.001","13.065","0.0009","17.742","0.002","75.376","0.005","82.739","0.005","86.361","0.005","2838.3","0.4","295","2","295","2","","","","","","","","6","P -1","-P 1","2","(TTN)Mo6Br14(PhCN)3","Molybdate(2-), dodeca-m-bromodibromohexa-, octahedro, salt with Naphthaceno[5,6-cd:11,12-c'd']bis[1,2]dithiole, compd. with benzonitrile (1:1:3)","","- C39 H23 Br14 Mo6 N3 S4 -","- C39 H23 Br14 Mo6 N3 S4 -","- C78 H46 Br28 Mo12 N6 S8 -","2","1","","Saito, Gunzi; Hosoda, Hidemasa; Yoshida, Yukihiro; Hagiwara, Jun; Nishimura, Kazukuni; Yamochi, Hideki; Otsuka, Akihiro; Hiramatsu, Takaaki; Shimazaki, Yuichi; Kirakci, Kaplan; Cordier, Stéphane; Perrin, Christiane","Synthesis and properties of charge-transfer solids with cluster units [Mo6X14]2− (X = Br, I)","Journal of Materials Chemistry","2012","22","37","19774","","10.1039/c2jm33086e","","","0.71073","MoKα","","0.0506","0.0506","","","0.1315","0.1315","","","","","","1.094","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208623","11.13","0.003","14.652","0.008","14.653","0.003","116.91","0.03","108.16","0.02","95.13","0.03","1948.3","1.5","","","","","","","","","","","","6","P -1","-P 1","2","(HMTTF)2Mo6I14(PhCN)4","Molybdate(2-), dodeca-m-iododiiodohexa-, octahedro, salt with 4H-Cyclopenta-1,3-dithiole, 2-(5,6-dihydro-4H-cyclopenta-1,3-dithiol- 2-ylidene)-5,6-dihydro-, compd. with benzonitrile (1:2:4)","","- C52 H44 I14 Mo6 N4 S8 -","- C52 H44 I14 Mo6 N4 S8 -","- C52 H44 I14 Mo6 N4 S8 -","1","0.5","","Saito, Gunzi; Hosoda, Hidemasa; Yoshida, Yukihiro; Hagiwara, Jun; Nishimura, Kazukuni; Yamochi, Hideki; Otsuka, Akihiro; Hiramatsu, Takaaki; Shimazaki, Yuichi; Kirakci, Kaplan; Cordier, Stéphane; Perrin, Christiane","Synthesis and properties of charge-transfer solids with cluster units [Mo6X14]2− (X = Br, I)","Journal of Materials Chemistry","2012","22","37","19774","","10.1039/c2jm33086e","","","0.71073","MoKα","","0.0953","0.0953","","","0.2509","0.2509","","","","","","1.122","","","","has coordinates,has disorder","180417","2020-10-21","18:00:00",""
"7208624","10.414","0.004","21.711","0.007","15.958","0.005","90","","93.65","0.03","90","","3601","2","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","(BO)2Mo6Br14(PhCN)3","Molybdate(2-), dodeca-m-bromodibromohexa-, octahedro , salt with 2-(5,6-dihydro-1,3-dithiolo[4,5-b][1,4]dioxin-2-ylidene)-5,6-dihydro- 1,3-dithiolo[4,5-b][1,4]dioxin, compd. with benzonitrile (1:2:4)","","- C48 H36 Br14 Mo6 N4 O8 S8 -","- C48 H36 Br14 Mo6 N4 O8 S8 -","- C96 H72 Br28 Mo12 N8 O16 S16 -","2","0.5","","Saito, Gunzi; Hosoda, Hidemasa; Yoshida, Yukihiro; Hagiwara, Jun; Nishimura, Kazukuni; Yamochi, Hideki; Otsuka, Akihiro; Hiramatsu, Takaaki; Shimazaki, Yuichi; Kirakci, Kaplan; Cordier, Stéphane; Perrin, Christiane","Synthesis and properties of charge-transfer solids with cluster units [Mo6X14]2− (X = Br, I)","Journal of Materials Chemistry","2012","22","37","19774","","10.1039/c2jm33086e","","","0.71073","MoKα","","0.0577","0.0577","","","0.0795","0.0795","","","","","","1.039","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208625","9.846","0.003","12.408","0.004","12.72","0.004","65.76","0.02","83.01","0.03","81.31","0.03","1397.6","0.8","295","2","295","2","","","","","","","","5","P -1","-P 1","2","(TTC1-TTF)2Mo6Br14","Molybdate(2-), dodeca-m-bromodibromohexa-, octahedro , salt with 1,3-Dithiole, 2-[4,5-bis(methylthio)-1,3-dithiol-2-ylidene]-4,5-bis(methylthio)- , compd. (1:2)","","- C20 H24 Br14 Mo6 S16 -","- C20 H24 Br14 Mo6 S16 -","- C20 H24 Br14 Mo6 S16 -","1","0.5","","Saito, Gunzi; Hosoda, Hidemasa; Yoshida, Yukihiro; Hagiwara, Jun; Nishimura, Kazukuni; Yamochi, Hideki; Otsuka, Akihiro; Hiramatsu, Takaaki; Shimazaki, Yuichi; Kirakci, Kaplan; Cordier, Stéphane; Perrin, Christiane","Synthesis and properties of charge-transfer solids with cluster units [Mo6X14]2− (X = Br, I)","Journal of Materials Chemistry","2012","22","37","19774","","10.1039/c2jm33086e","","","0.71073","MoKα","","0.0797","0.0797","","","0.1923","0.1923","","","","","","1.071","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208626","12.688","0.0008","13.9857","0.0009","14.2334","0.0009","89.64","0.001","83.243","0.001","85.746","0.001","2501.3","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","(perylene)6Mo6Br14","Molybdate(2-), dodeca-m-bromodibromohexa-, octahedro , salt with perylene, compd. (1:6)","","- C120 H72 Br14 Mo6 -","- C120 H72 Br14 Mo6 -","- C120 H72 Br14 Mo6 -","1","0.5","","Saito, Gunzi; Hosoda, Hidemasa; Yoshida, Yukihiro; Hagiwara, Jun; Nishimura, Kazukuni; Yamochi, Hideki; Otsuka, Akihiro; Hiramatsu, Takaaki; Shimazaki, Yuichi; Kirakci, Kaplan; Cordier, Stéphane; Perrin, Christiane","Synthesis and properties of charge-transfer solids with cluster units [Mo6X14]2− (X = Br, I)","Journal of Materials Chemistry","2012","22","37","19774","","10.1039/c2jm33086e","","","0.71073","MoKα","","0.0298","0.0298","","","0.075","0.075","","","","","","1.046","","","","has coordinates,has disorder","180417","2020-10-21","18:00:00",""
"7208627","13.088","0.004","13.41","0.004","15.62","0.004","94.76","0.03","116.67","0.03","87.57","0.03","2441.3","1.4","133.2","","133.2","","","","","","","","","7","P -1","-P 1","2","","","","- C94 H70 Br14 Cl2 Cu2 Mo6 N10 -","- C94 H70 Br14 Cl2 Cu2 Mo6 N10 -","- C94 H70 Br14 Cl2 Cu2 Mo6 N10 -","1","0.5","","Saito, Gunzi; Hosoda, Hidemasa; Yoshida, Yukihiro; Hagiwara, Jun; Nishimura, Kazukuni; Yamochi, Hideki; Otsuka, Akihiro; Hiramatsu, Takaaki; Shimazaki, Yuichi; Kirakci, Kaplan; Cordier, Stéphane; Perrin, Christiane","Synthesis and properties of charge-transfer solids with cluster units [Mo6X14]2− (X = Br, I)","Journal of Materials Chemistry","2012","22","37","19774","","10.1039/c2jm33086e","","","0.7107","MoKα","","","0.0413","","","","0.1011","","","","","","1.15","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208628","8.9685","0.0003","10.0847","0.0003","14.7906","0.0005","105.015","0.002","95.313","0.001","90.297","0.001","1285.91","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H30 N4 O2 -","- C30 H30 N4 O2 -","- C60 H60 N8 O4 -","2","1","","Wu, Cheng-An; Chou, Ho-Hsiu; Shih, Cheng-Hung; Wu, Fang-Iy; Cheng, Chien-Hong; Huang, Heh-Lung; Chao, Teng-Chih; Tseng, Mei-Rurng","Synthesis and physical properties of meta-terphenyloxadiazole derivatives and their application as electron transporting materials for blue phosphorescent and fluorescent devices","Journal of Materials Chemistry","2012","22","34","17792","","10.1039/c2jm33376g","","","0.71073","MoKα","","0.0456","0.0369","","","0.0997","0.1152","","","","","","1.094","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208629","10.107","0.002","10.762","0.002","11.847","0.003","76.07","0.03","73.47","0.04","62.02","0.03","1082.2","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H18 Cd N2 O7 -","- C25 H18 Cd N2 O7 -","- C50 H36 Cd2 N4 O14 -","2","1","","Tan, Yi; Fu, Zhiyong; Zeng, Yu; Chen, Hengjun; Liao, Shijun; Zhang, Jie; Dai, Jingcao","Highly stable photochromic crystalline material based on a close-packed layered metal‒viologen coordination polymer","Journal of Materials Chemistry","2012","22","34","17452","","10.1039/c2jm34341j","","","0.71073","MoKα","","0.0452","0.0281","","","0.065","0.0895","","","","","","1.062","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208630","18.6244","0.0004","10.2696","0.0003","8.7992","0.0002","90","","90","","90","","1682.98","0.07","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C14 H14 N8 O3 Zn -","- C14 H14 N8 O3 Zn -","- C56 H56 N32 O12 Zn4 -","4","1","","Wang, Fei; Yang, Hui; Kang, Yao; Zhang, Jian","Guest selectivity of a porous tetrahedral imidazolate framework material during self-assembly","Journal of Materials Chemistry","2012","22","37","19732","","10.1039/c2jm34506d","","","0.71073","MoKα","","0.0304","0.0273","","","0.0679","0.0698","","","","","","1","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208631","18.6627","0.0005","10.5533","0.0004","8.9082","0.0003","90","","90","","90","","1754.5","0.1","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C15 H17 N7 O3 Zn -","- C15 H17 N7 O3 Zn -","- C60 H68 N28 O12 Zn4 -","4","1","","Wang, Fei; Yang, Hui; Kang, Yao; Zhang, Jian","Guest selectivity of a porous tetrahedral imidazolate framework material during self-assembly","Journal of Materials Chemistry","2012","22","37","19732","","10.1039/c2jm34506d","","","0.71073","MoKα","","0.0655","0.0585","","","0.1406","0.1453","","","","","","1.233","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208632","18.4474","0.0007","10.6981","0.0006","8.9454","0.0004","90","","90","","90","","1765.39","0.14","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C16 H17 N7 O3 Zn -","- C16 H17 N7 O3 Zn -","- C64 H68 N28 O12 Zn4 -","4","1","","Wang, Fei; Yang, Hui; Kang, Yao; Zhang, Jian","Guest selectivity of a porous tetrahedral imidazolate framework material during self-assembly","Journal of Materials Chemistry","2012","22","37","19732","","10.1039/c2jm34506d","","","0.71073","MoKα","","0.0496","0.039","","","0.0893","0.0936","","","","","","1.042","","","","has coordinates","180417","2020-10-21","18:00:00",""
"7208633","15.665","0.001","13.512","0.0008","33.082","0.002","90","","99.933","0.001","90","","6897.4","0.7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C66 H59 Br4 Eu N10 O11 Zn2 -","- C66 H53 Br4 Eu N10 O11 Zn2 -","- C264 H212 Br16 Eu4 N40 O44 Zn8 -","4","1","","Du, Dong-Ying; Qin, Jun-Sheng; Sun, Cheng-Xin; Wang, Xin-Long; Zhang, Shu-Ran; Shen, Ping; Li, Shun-Li; Su, Zhong-Min; Lan, Ya-Qian","Functional heterometallic coordination polymers with metalloligands as tunable luminescent crystalline materials","Journal of Materials Chemistry","2012","22","37","19673","","10.1039/c2jm34661c","","","0.71069","MoKα","","0.1012","0.0545","","","0.1513","0.1744","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208634","15.755","0.0012","13.537","0.001","33.101","0.003","90","","99.782","0.001","90","","6957","1","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C66 H59 Br4 Eu0.75 N10 O11 Tb0.25 Zn2 -","- C66 H53 Br4 Eu0.75 N10 O11 Tb0.25 Zn2 -","- C264 H212 Br16 Eu3 N40 O44 Tb Zn8 -","4","1","","Du, Dong-Ying; Qin, Jun-Sheng; Sun, Cheng-Xin; Wang, Xin-Long; Zhang, Shu-Ran; Shen, Ping; Li, Shun-Li; Su, Zhong-Min; Lan, Ya-Qian","Functional heterometallic coordination polymers with metalloligands as tunable luminescent crystalline materials","Journal of Materials Chemistry","2012","22","37","19673","","10.1039/c2jm34661c","","","0.71069","MoKα","","0.1152","0.0601","","","0.1853","0.2174","","","","","","0.989","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208635","15.68","0.0009","13.515","0.0008","33.051","0.002","90","0.009","99.786","0.008","90","0.009","6902.1","0.7","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C66 H59 Br4 Eu0.5 N10 O11 Tb0.5 Zn2 -","- C66 H52 Br4 Eu0.5 N10 O11 Tb0.5 Zn2 -","- C264 H208 Br16 Eu2 N40 O44 Tb2 Zn8 -","4","1","","Du, Dong-Ying; Qin, Jun-Sheng; Sun, Cheng-Xin; Wang, Xin-Long; Zhang, Shu-Ran; Shen, Ping; Li, Shun-Li; Su, Zhong-Min; Lan, Ya-Qian","Functional heterometallic coordination polymers with metalloligands as tunable luminescent crystalline materials","Journal of Materials Chemistry","2012","22","37","19673","","10.1039/c2jm34661c","","","0.71069","MoKα","","0.1005","0.0517","","","0.1424","0.1638","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208636","15.676","0.002","13.514","0.0017","33.055","0.004","90","","99.803","0.002","90","","6900.3","1.5","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C66 H59 Br4 Eu0.25 N10 O11 Tb0.75 Zn2 -","- C66 H53 Br4 Eu0.25 N10 O11 Tb0.75 Zn2 -","- C264 H212 Br16 Eu N40 O44 Tb3 Zn8 -","4","1","","Du, Dong-Ying; Qin, Jun-Sheng; Sun, Cheng-Xin; Wang, Xin-Long; Zhang, Shu-Ran; Shen, Ping; Li, Shun-Li; Su, Zhong-Min; Lan, Ya-Qian","Functional heterometallic coordination polymers with metalloligands as tunable luminescent crystalline materials","Journal of Materials Chemistry","2012","22","37","19673","","10.1039/c2jm34661c","","","0.71069","MoKα","","0.1149","0.0557","","","0.1512","0.1786","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208637","15.634","0.0008","13.491","0.0007","33.079","0.0018","90","0.001","99.748","0.001","90","0.001","6876.2","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C66 H59 Br4 N10 O11 Tb Zn2 -","- C66 H53 Br4 N10 O11 Tb Zn2 -","- C264 H212 Br16 N40 O44 Tb4 Zn8 -","4","1","","Du, Dong-Ying; Qin, Jun-Sheng; Sun, Cheng-Xin; Wang, Xin-Long; Zhang, Shu-Ran; Shen, Ping; Li, Shun-Li; Su, Zhong-Min; Lan, Ya-Qian","Functional heterometallic coordination polymers with metalloligands as tunable luminescent crystalline materials","Journal of Materials Chemistry","2012","22","37","19673","","10.1039/c2jm34661c","","","0.71069","MoKα","","0.0927","0.0491","","","0.1355","0.1543","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208852","7.55","","10.43","","10.85","","90","","69.93","","90","","802.515","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tetracalcium difluoride disilicate","","- Ca4 F2 O7 Si2 -","- Ca16 F8 O28 Si8 -","- Ca16 F8 O28 Si8 -","","","","Huang, Chien-Hao; Chan, Ting-Shan; Liu, Wei-Ren; Wang, De-Yin; Chiu, Yi-Chen; Yeh, Yao-Tsung; Chen, Teng-Ming","Crystal structure of blue‒white‒yellow color-tunable Ca4Si2O7F2:Eu2+,Mn2+ phosphor and investigation of color tunability through energy transfer for single-phase white-light near-ultraviolet LEDs","Journal of Materials Chemistry","2012","22","38","20210","","10.1039/c2jm33160h","","","","","","","","","","","","","","","","","","","","","has coordinates","180419","2020-10-21","18:00:00",""
"7208853","5.1756","0.0002","16.4142","0.0006","17.0191","0.0006","84.227","0.003","85.377","0.003","82.2","0.004","1421.9","0.09","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C56 H66 S12 -","- C56 H66 S12 -","- C56 H66 S12 -","1","0.5","","Gentili, Denis; Di Maria, Francesca; Liscio, Fabiola; Ferlauto, Laura; Leonardi, Francesca; Maini, Lucia; Gazzano, Massimo; Milita, Silvia; Barbarella, Giovanna; Cavallini, Massimiliano","Targeting ordered oligothiophene fibers with enhanced functional properties by interplay of self-assembly and wet lithography","Journal of Materials Chemistry","2012","22","39","20852","","10.1039/c2jm33998f","","","0.71073","MoKα","","0.1301","0.0926","","","0.1635","0.1787","","","","","","1.227","","","","has coordinates,has disorder","180419","2020-10-21","18:00:00",""
"7208854","6.4194","0.0013","8.268","0.0017","15.213","0.003","90","","92.69","0.03","90","","806.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 N4 O4 -","- C18 H14 N4 O4 -","- C36 H28 N8 O8 -","2","0.5","","Qu, Songnan; Lu, Qipeng; Wu, Shaohang; Wang, Lijun; Liu, Xingyuan","Two dimensional directed π‒π interactions in a linear shaped bi-1,3,4-oxadiazole derivative to achieve organic single crystal with highly polarized fluorescence and amplified spontaneous emissions","Journal of Materials Chemistry","2012","22","47","24605","","10.1039/c2jm35002e","","","0.71073","MoKα","","0.058","0.0368","","","0.0916","0.0983","","","","","","1.087","","","","has coordinates","180419","2020-10-21","18:00:00",""
"7208855","8.0873","0.0016","8.1278","0.0016","9.3175","0.0019","107.15","0.03","105.03","0.03","97.99","0.03","549.6","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H26 N4 O4 -","- C24 H26 N4 O4 -","- C24 H26 N4 O4 -","1","0.5","","Qu, Songnan; Lu, Qipeng; Wu, Shaohang; Wang, Lijun; Liu, Xingyuan","Two dimensional directed π‒π interactions in a linear shaped bi-1,3,4-oxadiazole derivative to achieve organic single crystal with highly polarized fluorescence and amplified spontaneous emissions","Journal of Materials Chemistry","2012","22","47","24605","","10.1039/c2jm35002e","","","0.71073","MoKα","","0.0478","0.0386","","","0.1226","0.127","","","","","","1.079","","","","has coordinates","180419","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",""
"7209383","4.601","","7.371","","7.881","","90","","90","","90","","267.276","","","","","","","","","","","","","3","I m m 2","I 2 -2","44","","Eu Au Ge","","- Au Eu Ge -","- Au Eu Ge -","- Au4 Eu4 Ge4 -","4","0.5","","Poettgen, R.","Crystal structure, magnetic susceptibility and electrical conductivity of Eu Au Ge: a new ordered version of the Ce Cu2 - type structure","Journal of Materials Chemistry","1995","5","","505","508","10.1039/jm9950500505","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209384","7.552","","4.722","","8.423","","90","","90","","90","","300.369","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Eu Au In","","- Au Eu In -","- Au Eu In -","- Au4 Eu4 In4 -","4","0.5","","Poettgen, R.","Metamagnetism in Eu Pd In and Eu Au In","Journal of Materials Chemistry","1996","6","","63","67","10.1039/jm9960600063","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209391","4.6708","","4.6708","","6.037","","90","","90","","120","","114.06","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Li Au Sn","","- Au Li Sn -","- Au Li Sn -","- Au2 Li2 Sn2 -","2","0.0833333","","Wu Zhi-Yun; Johrendt, D.; Poettgen, R.; Hoffmann, R.D.","The stannides Li Au Sn and Li Au3 Sn4 - syntheses, structure and chemical bonding","Journal of Materials Chemistry","2002","12","","676","680","10.1039/b109381a","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209397","4.195","","4.195","","3.972","","90","","90","","120","","60.535","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","U Au Si","","- Au Si U -","- Au Si U -","- Au Si U -","1","0.0833333","","Troc, R.; Poettgen, R.; Hoffmann, R.D.; Kaczorowski, D.; Tran, V.H.","Crystal structure and physical properties of U Au Si and U Au2","Journal of Materials Chemistry","1996","6","","429","434","10.1039/jm9960600429","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209416","4.4831","","4.4831","","20.557","","90","","90","","120","","357.806","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Li Au3 Sn4","","- Au3 Li Sn4 -","- Au3 Li Sn4 -","- Au6 Li2 Sn8 -","2","0.166667","","Johrendt, D.; Wu Zhi-Yun; Poettgen, R.; Hoffmann, R.D.","The stannides Li Au Sn and Li Au3 Sn4 - syntheses, structure and chemical bonding","Journal of Materials Chemistry","2002","12","","676","680","10.1039/b109381a","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209446","8.078","","15.981","","3.5519","","90","","101.26","","90","","449.705","","","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Ca4 Gd O (B O3)3","","- B3 Ca4 Gd O10 -","- B3 Ca4 Gd O10 -","- B6 Ca8 Gd2 O20 -","2","0.5","","Kahn-Harari, A.; Aka, G.; Mougel, F.; Pelenc, D.","Structural and thermal stability of Czochralski grown Gd C O B oxoborate single crystals","Journal of Materials Chemistry","1998","8","","1619","1623","10.1039/a800492g","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209458","3.8974","","3.8974","","26.64929","","90","","90","","90","","404.795","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","(Nd1.5 Ce0.5) (Sr1.5 Nd0.5) Cu2 O6 (B O3)","","- B Ce0.5 Cu2 Nd2 O9 Sr1.5 -","- B Ce0.5 Cu2 Nd2 O9 Sr1.5 -","- B2 Ce Cu4 Nd4 O18 Sr3 -","2","0.0625","","Li, R.-K.","Preparation and structure of Nd2 Sr1.5 Ce0.5 Cu2 O6 B O3: a 1222 phase containing a borate group as a connecting element","Journal of Materials Chemistry","1995","5","","1973","1974","10.1039/jm9950501973","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209462","9.8552","","8.4007","","4.4138","","90","","90","","90","","365.421","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cr3 (B O6)","","- B Cr3 O6 -","- B Cr3 O6 -","- B4 Cr12 O24 -","4","0.5","","Nazar, L.F.; Rowsell, J.L.C.","Synthesis, structure, and solid-state electrochemical properties of Ce3 B O6: a new chromium(III) borate with the norbergite structure","Journal of Materials Chemistry","2001","11","","3228","3233","10.1039/b100707f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209467","3.17","","9.3847","","9.2498","","90","","90.22","","90","","275.175","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Fe2 O (B O3)","","- B Fe2 O4 -","- B Fe2 O4 -","- B4 Fe8 O16 -","4","1","","Attfield, J.P.; Rodriguez-Martinez, L.M.; Greneche, J.M.; Cernik, R.J.; Bell, A.M.T.; Clarke, J.F.; le Blanc, M.; Retoux, R.; Perkins, D.A.","Synthesis, structure and properties of a semivalent iron oxoborate, Fe2 O B O3","Journal of Materials Chemistry","1998","9","","205","209","10.1039/a804642e","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7210557","8.92885","0.00003","7.098858","0.00002","9.2593","0.00003","90","","90","","90","","586.897","0.003","293","","","","","","","","","","","6","I m m a","-I 2b 2","74","","","","- C2 H3 Al F5 N3 Zn -","- C2 H3 Al F5 N3 Zn -","- C8 H12 Al4 F20 N12 Zn4 -","4","0.25","","Cadiau, Amandine; Martineau, Charlotte; Leblanc, Marc; Maisonneuve, Vincent; Hémon-Ribaud, Annie; Taulelle, Francis; Adil, Karim","ZnAlF5.[TAZ]: an Al fluorinated MOF of MIL-53(Al) topology with cationic {Zn(1,2,4 triazole)}2+ linkers","Journal of Materials Chemistry","2011","21","11","3949","3951","10.1039/c0jm03559a","powder diffraction","","","CuKα","","","","","","","","","3.1162","1.67","","","","","","","has coordinates","180436","2020-10-21","18:00:00",""
"7211492","18.6057","0.0003","11.2046","0.0002","18.7297","0.0005","90","","103.224","0.001","90","","3801.03","0.14","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H33 Cl2 Cu2 N8 O14 -","- C28 H33 Cl2 Cu2 N8 O14 -","- C112 H132 Cl8 Cu8 N32 O56 -","4","1","","Kolotilov, Sergey V.; Cador, Olivier; Pointillart, Fabrice; Golhen, Stéphane; Le Gal, Yann; Gavrilenko, Konstantin S.; Ouahab, Lahcène","A new approach towards ferromagnetic conducting materials based on TTF-containing polynuclear complexes","Journal of Materials Chemistry","2010","20","42","9505","","10.1039/b925178b","","","0.71073","MoKα","","0.1071","0.067","","","0.1771","0.2089","","","","","","1.038","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211493","11.4326","0.0003","17.9255","0.0007","23.2958","0.001","90","","98.79","0.02","90","","4718.1","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H44 Cl Cu2 N8 O13 S4 -","- C37 H44 Cl Cu2 N8 O13 S4 -","- C148 H176 Cl4 Cu8 N32 O52 S16 -","4","1","","Kolotilov, Sergey V.; Cador, Olivier; Pointillart, Fabrice; Golhen, Stéphane; Le Gal, Yann; Gavrilenko, Konstantin S.; Ouahab, Lahcène","A new approach towards ferromagnetic conducting materials based on TTF-containing polynuclear complexes","Journal of Materials Chemistry","2010","20","42","9505","","10.1039/b925178b","","","0.71073","MoKα","","0.1782","0.1005","","","0.2836","0.3192","","","","","","1.032","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211494","20.3545","0.0004","9.9403","0.0002","30.9701","0.0009","90","","105.089","0.001","90","","6050.1","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H60 Cl2 Cu2 N12 O14 -","- C54 H60 Cl2 Cu2 N12 O14 -","- C216 H240 Cl8 Cu8 N48 O56 -","4","0.5","","Kolotilov, Sergey V.; Cador, Olivier; Pointillart, Fabrice; Golhen, Stéphane; Le Gal, Yann; Gavrilenko, Konstantin S.; Ouahab, Lahcène","A new approach towards ferromagnetic conducting materials based on TTF-containing polynuclear complexes","Journal of Materials Chemistry","2010","20","42","9505","","10.1039/b925178b","","","0.71073","MoKα","","0.16","0.0717","","","0.1938","0.2555","","","","","","0.975","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211495","11.316","0.001","22.212","0.001","23.497","0.001","90","","97.312","0.001","90","","5858","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C41 H41 Cl2 Cu2 N9 O13 S4 -","- C41 H41 Cl2 Cu2 N9 O13 S4 -","- C164 H164 Cl8 Cu8 N36 O52 S16 -","4","1","","Kolotilov, Sergey V.; Cador, Olivier; Pointillart, Fabrice; Golhen, Stéphane; Le Gal, Yann; Gavrilenko, Konstantin S.; Ouahab, Lahcène","A new approach towards ferromagnetic conducting materials based on TTF-containing polynuclear complexes","Journal of Materials Chemistry","2010","20","42","9505","","10.1039/b925178b","","","0.71073","MoKα","","0.0952","0.0609","","","0.1792","0.1968","","","","","","0.986","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211558","8.234","0.0016","11.958","0.002","12.198","0.002","81.48","0.03","85.5","0.03","87.63","0.03","1183.6","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H58 S4 Si2 -","- C52 H58 S4 Si2 -","- C52 H58 S4 Si2 -","1","0.5","","Chung, Dae Sung; Park, Jong Won; Park, Jong-Hwa; Moon, Dohyun; Kim, Ghyung Hwa; Lee, Heung-Soo; Lee, Dong Hoon; Shim, Hong-Ku; Kwon, Soon-Ki; Park, Chan Eon","High mobility organic single crystal transistors based on soluble triisopropylsilylethynyl anthracene derivatives","Journal of Materials Chemistry","2010","20","3","524","","10.1039/b910226d","","","0.75","synchrotron","","0.0538","0.0517","","","0.1513","0.154","","","","","","1.04","","","","has coordinates,has disorder","180446","2020-10-21","18:00:00",""
"7211559","8.1903","0.0016","11.438","0.002","12.144","0.002","78.37","0.03","88.17","0.03","85.1","0.03","1110.1","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C56 H62 Si2 -","- C56 H62 Si2 -","- C56 H62 Si2 -","1","0.5","","Chung, Dae Sung; Park, Jong Won; Park, Jong-Hwa; Moon, Dohyun; Kim, Ghyung Hwa; Lee, Heung-Soo; Lee, Dong Hoon; Shim, Hong-Ku; Kwon, Soon-Ki; Park, Chan Eon","High mobility organic single crystal transistors based on soluble triisopropylsilylethynyl anthracene derivatives","Journal of Materials Chemistry","2010","20","3","524","","10.1039/b910226d","","","0.75","synchrotron","","0.0532","0.0429","","","0.1104","0.1359","","","","","","1.096","","","","has coordinates","180446","2020-10-21","18:00:00",""
"7211710","29.925","0.004","6.9672","0.0008","23.953","0.003","90","","99.85","0.007","90","","4920.4","1.1","113","2","113","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H14 F6 S6 -","- C25 H14 F6 S6 -","- C200 H112 F48 S48 -","8","1","","Lin, Hui; Xu, Wei; Zhu, Daoben","1,2-Bis (3,5-dimethyl dithioene [3,2-b:2′,3′-d]thiophene -2-yl) perfluorocyclopentene: synthesis and photochromic reaction in solution and LB films","Journal of Materials Chemistry","2010","20","5","884","","10.1039/b913149c","","","0.7107","MoKα","","0.091","0.0752","","","0.1873","0.203","","","","","","1.097","","","","has coordinates,has disorder","180448","2020-10-21","18:00:00",""
"7211770","8.7397","0.0017","10.125","0.002","15.635","0.003","90","","90.98","0.03","90","","1383.3","0.5","173","2","173","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C42 H28 -","- C42 H28 -","- C84 H56 -","2","0.5","","Huang, Liwei; Liao, Qing; Shi, Qiang; Fu, Hongbing; Ma, Jinshi; Yao, Jiannian","Rubrene micro-crystals from solution routes: their crystallography, morphology and optical properties","Journal of Materials Chemistry","2010","20","1","159","","10.1039/b914334c","","","0.71073","MoKα","","0.0532","0.0494","","","0.1178","0.1203","","","","","","1.099","","","","has coordinates","180448","2020-10-21","18:00:00",""
"7211771","7.0196","0.0014","8.5432","0.0017","11.948","0.002","93.04","0.03","105.58","0.03","96.28","0.03","683.5","0.3","173","2","173","2","","","","","","","","2","P -1","-P 1","2","","","","- C42 H28 -","- C42 H28 -","- C42 H28 -","1","0.5","","Huang, Liwei; Liao, Qing; Shi, Qiang; Fu, Hongbing; Ma, Jinshi; Yao, Jiannian","Rubrene micro-crystals from solution routes: their crystallography, morphology and optical properties","Journal of Materials Chemistry","2010","20","1","159","","10.1039/b914334c","","","0.71073","MoKα","","0.0761","0.0672","","","0.2058","0.2149","","","","","","1.196","","","","has coordinates","180448","2020-10-21","18:00:00",""
"7211888","8.1678","0.0006","21.9108","0.0017","23.0033","0.0018","90","","94.181","0.001","90","","4105.8","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-(2-(2-(1,1-Dimethyl-5,6-dihydro-1H,4H-pyrrolo(3,2,1-ij) quinolin-2-ylidene)-ethylidene)-3-oxo-indan-1-ylidene) -malononitrile","2-{2-[2-(1,1-Dimethyl-5,6-dihydro-1H,4H-pyrrolo[3,2,1-ij] quinolin-2-ylidene)-ethylidene]-3-oxo-indan-1-ylidene} -malononitrile","","- C27 H21 N3 O -","- C27 H21 N3 O -","- C216 H168 N24 O8 -","8","2","","Bürckstümmer, Hannah; Kronenberg, Nils Michael; Gsänger, Marcel; Stolte, Matthias; Meerholz, Klaus; Würthner, Frank","Tailored merocyanine dyes for solution-processed BHJ solar cells","Journal of Materials Chemistry","2010","20","2","240","","10.1039/b916181c","","","0.71073","MoKα","","0.0863","0.0602","","","0.1185","0.1309","","","","","","1.127","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7211916","20.539","0.002","20.539","0.002","6.9994","0.001","90","","90","","90","","2952.7","0.6","100","2","100","2","","","","","","","","4","P 42/n :2","-P 4bc","86","","","","- C12 H6 Cu O8 -","- C12 H6 Cu O8 -","- C96 H48 Cu8 O64 -","8","1","","Kanoo, Prakash; Gurunatha, K. L.; Maji, Tapas Kumar","Versatile functionalities in MOFs assembled from the same building units: interplay of structural flexibility, rigidity and regularity","Journal of Materials Chemistry","2010","20","7","1322","","10.1039/b917029d","","","0.71073","MoKα","","0.0405","0.0329","","","0.1016","0.1158","","","","","","1.139","","","","has coordinates","180450","2020-10-21","18:00:00",""
"7211917","16.1983","0.0008","14.3762","0.0008","12.8497","0.0007","90","","90","","90","","2992.3","0.3","100","2","100","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C14 H14 Cu O6 -","- C14 H14 Cu O6 -","- C112 H112 Cu8 O48 -","8","1","","Kanoo, Prakash; Gurunatha, K. L.; Maji, Tapas Kumar","Versatile functionalities in MOFs assembled from the same building units: interplay of structural flexibility, rigidity and regularity","Journal of Materials Chemistry","2010","20","7","1322","","10.1039/b917029d","","","0.71073","MoKα","","0.1255","0.0639","","","0.1787","0.2341","","","","","","1.058","","","","has coordinates","180450","2020-10-21","18:00:00",""
"7211918","10.8058","0.0006","10.8058","0.0006","14.2168","0.0013","90","","90","","90","","1660","0.2","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- C12 H4 Cu O6.8 -","- C12 H4 Cu O6.8 -","- C48 H16 Cu4 O27.2 -","4","0.125","","Kanoo, Prakash; Gurunatha, K. L.; Maji, Tapas Kumar","Versatile functionalities in MOFs assembled from the same building units: interplay of structural flexibility, rigidity and regularity","Journal of Materials Chemistry","2010","20","7","1322","","10.1039/b917029d","","","0.71073","MoKα","","0.091","0.0861","","","0.2679","0.2715","","","","","","1.199","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7211919","10.8058","0.0006","10.8058","0.0006","14.2168","0.0013","90","","90","","90","","1660","0.2","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- C12 H4 Cu O5.63 -","- C12 H4 Cu O5.62 -","- C48 H16 Cu4 O22.48 -","4","0.125","","Kanoo, Prakash; Gurunatha, K. L.; Maji, Tapas Kumar","Versatile functionalities in MOFs assembled from the same building units: interplay of structural flexibility, rigidity and regularity","Journal of Materials Chemistry","2010","20","7","1322","","10.1039/b917029d","","","0.71073","MoKα","","0.088","0.0832","","","0.2472","0.2509","","","","","","1.2","","","","has coordinates","180450","2020-10-21","18:00:00",""
"7211980","5.421","0.002","9.8","0.004","29.833","0.013","90.125","0.006","91.359","0.006","97.34","0.006","1571.5","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H46 Cl2 N2 O2 -","- C32 H46 Cl2 N2 O2 -","- C64 H92 Cl4 N4 O4 -","2","1","","Lee, Dong-Chan; Cao, Bin; Jang, Kyoungmi; Forster, Paul M.","Self-assembly of halogen substituted phenazines","Journal of Materials Chemistry","2010","20","5","867","","10.1039/b917601b","","","0.7749","","","0.0592","0.0409","","","0.1089","0.12","","","","","","1.02","","","","has coordinates","180450","2020-10-21","18:00:00",""
"7212040","28.047","0.003","16.0284","0.0013","7.4162","0.0006","90","","101.761","0.002","90","","3264","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C42 H24 S6 -","- C42 H24 S6 -","- C168 H96 S24 -","4","0.5","","Luo, Jing; Zhao, Baomin; On Chan, Hardy Sze; Chi, Chunyan","Synthesis, physical properties and self-assembly of star-shaped oligothiophenes-substituted and fused triphenylenes","Journal of Materials Chemistry","2010","20","10","1932","","10.1039/b918671a","","","0.71073","MoKα","","0.0763","0.0624","","","0.1536","0.1617","","","","","","1.067","","","","has coordinates","180451","2020-10-21","18:00:00",""
"7212094","15.8475","0.0014","15.8514","0.0014","6.9724","0.0004","90","","98.498","0.006","90","","1732.3","0.2","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 S3 -","- C22 H12 S3 -","- C88 H48 S12 -","4","1","","Afonina, Irina; Skabara, Peter J.; Vilela, Filipe; Kanibolotsky, Alexander L.; Forgie, John C.; Bansal, Ashu K.; Turnbull, Graham A.; Samuel, Ifor D. W.; Labram, John G.; Anthopoulos, Thomas D.; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of new diindenodithienothiophene (DITT) based materials","Journal of Materials Chemistry","2010","20","6","1112","","10.1039/b919574b","","","0.71073","MoKα","","0.1583","0.1079","","","0.2576","0.2819","","","","","","1.104","","","","has coordinates","180451","2020-10-21","18:00:00",""
"7212095","10.569","0.0003","10.569","","10.569","","90","","90","","90","","1180.6","0.03","","","","","","","","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Nb2 O7 -","- Nb2 O7 -","- Nb16 O56 -","8","0.0416667","","Wu, Jianjun; Li, Jiangtian; Lü, Xujie; Zhang, Linlin; Yao, Jiyong; Zhang, Fuxiang; Huang, Fuqiang; Xu, Fangfang","A one-pot method to grow pyrochlore H4Nb2O7-octahedron-based photocatalyst","Journal of Materials Chemistry","2010","20","10","1942","","10.1039/b919594g","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7212124","9.6702","0.0006","14.2059","0.001","11.0365","0.0007","90","","123.306","0.004","90","","1267.1","0.15","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 O2 -","- C34 H34 O2 -","- C68 H68 O4 -","2","0.5","","Wöbkenberg, Paul H.; Labram, John G.; Swiecicki, Jean-Marie; Parkhomenko, Ksenia; Sredojevic, Dusan; Gisselbrecht, Jean-Paul; de Leeuw, Dago M.; Bradley, Donal D. C.; Djukic, Jean-Pierre; Anthopoulos, Thomas D.","Ambipolar organic transistors and near-infrared phototransistors based on a solution-processable squarilium dye","Journal of Materials Chemistry","2010","20","18","3673","","10.1039/b919970e","","","0.71073","MoKα","","0.1014","0.056","","","0.1198","0.1373","","","","","","1.017","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212130","9.2204","0.0003","17.0061","0.0006","35.2109","0.0012","90","","90","","90","","5521.2","0.3","120","2","120","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C37 H27 Cr N Na O14 S24 -","- C37 H27 Cr N Na O14 S24 -","- C148 H108 Cr4 N4 Na4 O56 S96 -","4","1","","Martin, Lee; Day, Peter; Horton, Peter; Nakatsuji, Shin'ichi; Yamada, Jun'ichi; Akutsu, Hiroki","Chiral conducting salts of BEDT-TTF containing a single enantiomer of tris(oxalato)chromate(III) crystallised from a chiral solvent","Journal of Materials Chemistry","2010","20","14","2738","","10.1039/b920224b","","","0.71073","MoKα","","0.0803","0.0635","","","0.1348","0.1425","","","","","","1.055","","","","has coordinates,has disorder","180452","2020-10-21","18:00:00",""
"7212131","10.4406","0.0004","14.5752","0.0007","18.1024","0.001","90","","94.02","0.003","90","","2747.9","0.2","120","2","120","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C37 H27 Cr N Na O14 S24 -","- C37 H27 Cr N Na O14 S24 -","- C74 H54 Cr2 N2 Na2 O28 S48 -","2","1","","Martin, Lee; Day, Peter; Horton, Peter; Nakatsuji, Shin'ichi; Yamada, Jun'ichi; Akutsu, Hiroki","Chiral conducting salts of BEDT-TTF containing a single enantiomer of tris(oxalato)chromate(III) crystallised from a chiral solvent","Journal of Materials Chemistry","2010","20","14","2738","","10.1039/b920224b","","","0.71073","MoKα","","0.1494","0.0972","","","0.1898","0.2191","","","","","","1.104","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212132","17.0777","0.0005","14.5272","0.0005","16.8848","0.0005","90","","115.574","0.001","90","","3778.6","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H36 N4 O -","- C50 H36 N4 O -","- C200 H144 N16 O4 -","4","1","","Tao, Youtian; Wang, Qiang; Ao, Liang; Zhong, Cheng; Qin, Jingui; Yang, Chuluo; Ma, Dongge","Molecular design of host materials based on triphenylamine/oxadiazole hybrids for excellent deep-red phosphorescent organic light-emitting diodes","Journal of Materials Chemistry","2010","20","9","1759","","10.1039/b920227g","","","0.71073","MoKα","","0.1296","0.0606","","","0.1268","0.1612","","","","","","0.99","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212163","10.84273","0.00013","6.16644","0.00006","12.75239","0.00014","90","","106.176","0.001","90","","818.88","0.016","","","300","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- Na2 Nb4 O11 -","- Na2 Nb4 O11 -","- Na8 Nb16 O44 -","4","1","","Masó, Nahum; West, Anthony R.","A new family of ferroelectric materials: Me2Nb4O11 (Me = Na and Ag)","Journal of Materials Chemistry","2010","20","11","2082","","10.1039/b921115b","","","1.54056","CuKα1","","","0.068","","","","0.1001","","","1.72","","","","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212164","10.76422","0.00011","6.20097","0.00005","12.85819","0.00013","90","","106.183","0.0015","90","","824.259","0.015","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- Ag2 Nb4 O11 -","- Ag2 Nb4 O11 -","- Ag8 Nb16 O44 -","4","1","","Masó, Nahum; West, Anthony R.","A new family of ferroelectric materials: Me2Nb4O11 (Me = Na and Ag)","Journal of Materials Chemistry","2010","20","11","2082","","10.1039/b921115b","","","","","","","0.0665","","","","0.0928","","","1.19","","","","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212191","9.229","0.0004","9.8631","0.0005","12.4794","0.0006","107.066","0.002","97.152","0.003","96.245","0.003","1064.77","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 Eu2 N4 O12 -","- C38 H48 Eu2 N4 O12 -","- C38 H48 Eu2 N4 O12 -","1","0.5","","Zucchi, Gaël; Jeon, Taewoo; Tondelier, Denis; Aldakov, Dmitry; Thuéry, Pierre; Ephritikhine, Michel; Geffroy, Bernard","White electroluminescence of lanthanide complexes resulting from exciplex formation","Journal of Materials Chemistry","2010","20","11","2114","","10.1039/b921740a","","","0.71073","MoKα","","0.0174","0.0155","","","0.0363","0.0367","","","","","","1.066","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212192","9.2276","0.0006","9.8575","0.001","12.4828","0.0013","106.977","0.005","97.121","0.006","96.48","0.006","1064.22","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 N4 O12 Tb2 -","- C38 H48 N4 O12 Tb2 -","- C38 H48 N4 O12 Tb2 -","1","0.5","","Zucchi, Gaël; Jeon, Taewoo; Tondelier, Denis; Aldakov, Dmitry; Thuéry, Pierre; Ephritikhine, Michel; Geffroy, Bernard","White electroluminescence of lanthanide complexes resulting from exciplex formation","Journal of Materials Chemistry","2010","20","11","2114","","10.1039/b921740a","","","0.71073","MoKα","","0.0381","0.0311","","","0.0722","0.0744","","","","","","1.006","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212193","9.2497","0.0007","9.9437","0.001","12.4584","0.0013","107.516","0.005","96.94","0.006","95.639","0.006","1073.71","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 N4 O12 Sm2 -","- C38 H48 N4 O12 Sm2 -","- C38 H48 N4 O12 Sm2 -","1","0.5","","Zucchi, Gaël; Jeon, Taewoo; Tondelier, Denis; Aldakov, Dmitry; Thuéry, Pierre; Ephritikhine, Michel; Geffroy, Bernard","White electroluminescence of lanthanide complexes resulting from exciplex formation","Journal of Materials Chemistry","2010","20","11","2114","","10.1039/b921740a","","","0.71073","MoKα","","0.0403","0.0331","","","0.0736","0.0761","","","","","","1.011","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7212278","12.4058","0.0003","12.7466","0.0003","22.2219","0.0005","85.946","0.001","80.488","0.001","86.8971","0.0011","3453.78","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H68 N8 O21 S6 -","- C60 H68 N8 O21 S6 -","- C120 H136 N16 O42 S12 -","2","1","","Bolduc, Andréanne; Dufresne, Stéphane; Skene, W. G.","EDOT-containing azomethine: an easily prepared electrochromically active material with tuneable colours","Journal of Materials Chemistry","2010","20","23","4820","","10.1039/b923821b","","","1.54178","CuKα","","0.0928","0.0627","","","0.1365","0.149","","","","","","0.933","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7212279","8.305","0.0017","14.729","0.003","15.728","0.003","90","","98.9","0.03","90","","1900.8","0.7","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","ammoniated lithium dodecahydrododecaborates","","","- B12 H33 Li2 N7 -","- B12 H33 Li2 N7 -","- B48 H132 Li8 N28 -","4","1","","Huang, Zhenguo; Gallucci, Judith; Chen, Xuenian; Yisgedu, Teshome; Lingam, Hima Kumar; Shore, Sheldon G.; Zhao, Ji-Cheng","Li2B12H12·7NH3: a new ammine complex for ammonia storage or indirect hydrogen storage","Journal of Materials Chemistry","2010","20","14","2743","","10.1039/b923829h","","","0.71073","MoKα","","0.1369","0.0584","","","0.1551","0.1849","","","","","","1.038","","","","has coordinates","180453","2020-10-21","18:00:00",""
"7212337","15.236","0.0006","10.8257","0.0004","20.7997","0.0008","90","","90","","90","","3430.7","0.2","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,5-diamino-1H-tetrazol-4-ium 5-nitrotetrazol-1-ide","","- C2 H5 N11 O2 -","- C2 H5 N11 O2 -","- C32 H80 N176 O32 -","16","2","","Tao, Guo-Hong; Guo, Yong; Parrish, Damon A.; Shreeve, Jean'ne M.","Energetic 1,5-diamino-4H-tetrazolium nitro-substituted azolates","Journal of Materials Chemistry","2010","20","15","2999","","10.1039/b925267c","","","1.54178","CuKα","","0.0358","0.0343","","","0.0974","0.0989","","","","","","1.039","","","","has coordinates","180454","2020-10-21","18:00:00",""
"7212355","6.337","0.004","19.79","0.005","6.947","0.005","90","","95.21","0.03","90","","867.6","0.9","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C9 H14 Cl6 N2 O4 -","- C9 H14 Cl6 N2 O4 -","- C18 H28 Cl12 N4 O8 -","2","1","","Cai, Hong-Ling; Zhang, Tong; Chen, Li-Zhuang; Xiong, Ren-Gen","The first homochiral compound with temperature-independence of piezoelectric properties","Journal of Materials Chemistry","2010","20","10","1868","","10.1039/b926053f","","","0.71073","MoKα","","0.0882","0.0588","","","0.1196","0.1381","","","","","","1.058","","","","has coordinates","180454","2020-10-21","18:00:00",""
"7212356","9.2119","0.0018","11.087","0.002","11.866","0.002","85.7","0.03","76.62","0.03","72.83","0.03","1126.4","0.4","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C40 H54 Bi Cl7 N4 O5 -","- C40 H54 Bi Cl7 N4 O5 -","- C40 H54 Bi Cl7 N4 O5 -","1","1","","Cai, Hong-Ling; Zhang, Tong; Chen, Li-Zhuang; Xiong, Ren-Gen","The first homochiral compound with temperature-independence of piezoelectric properties","Journal of Materials Chemistry","2010","20","10","1868","","10.1039/b926053f","","","0.71073","MoKα","","0.0319","0.0317","","","0.0696","0.0739","","","","","","0.864","","","","has coordinates","180454","2020-10-21","18:00:00",""
"7212385","22.649","0.004","22.649","0.004","7.744","0.001","90","","90","","120","","3440.3","1","303","1","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H21 Eu O6 -","- C27 H21 Eu O6 -","- C162 H126 Eu6 O36 -","6","0.333333","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.019","","","","0.024","","","","","","1.054","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212386","22.647","0.004","22.647","0.004","7.703","0.001","90","","90","","120","","3421.5","1","303","1","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H21 O6 Tb -","- C27 H21 O6 Tb -","- C162 H126 O36 Tb6 -","6","0.333333","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.035","","","","0.038","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212387","22.654","0.006","22.654","0.006","7.722","0.002","90","","90","","120","","3432","1.6","301","1","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H21 Gd O6 -","- C27 H21 Gd O6 -","- C162 H126 Gd6 O36 -","6","0.333333","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.018","","","","0.022","","","","","","1.043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212388","11.548","0.001","7.886","0.001","13.048","0.001","90","","94.15","0.01","90","","1185.1","0.2","301","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H21 Er O6 -","- C27 H21 Er O6 -","- C54 H42 Er2 O12 -","2","1","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.022","","","","0.027","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212389","11.544","0.001","7.9169","0.0009","13.071","0.002","90","","94.136","0.002","90","","1191.5","0.2","301","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H21 Ho O6 -","- C27 H21 Ho O6 -","- C54 H42 Ho2 O12 -","2","1","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.021","","","","0.026","","","","","","1.038","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212390","11.574","0.002","7.848","0.002","13.043","0.003","90","","94.384","0.003","90","","1181.3","0.5","301","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H21 O6 Yb -","- C27 H21 O6 Yb -","- C54 H42 O12 Yb2 -","2","1","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.03","","","","0.037","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212391","11.5429","0.001","7.9186","0.0007","13.0625","0.0011","90","","94.139","0.002","90","","1190.85","0.18","301","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H21 O6 Y -","- C27 H21 O6 Y -","- C54 H42 O12 Y2 -","2","1","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.029","","","","0.028","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212392","11.564","0.001","7.8702","0.0009","13.042","0.002","90","","94.28","0.002","90","","1183.7","0.2","301","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H21 O6 Tm -","- C27 H21 O6 Tm -","- C54 H42 O12 Tm2 -","2","1","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.02","","","","0.021","","","","","","1.046","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212393","11.5204","0.0011","7.9361","0.0007","13.0778","0.0012","90","","94.049","0.002","90","","1192.68","0.19","301","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H21 Dy O6 -","- C27 H21 Dy O6 -","- C54 H42 Dy2 O12 -","2","1","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.019","","","","0.023","","","","","","1.014","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212394","22.636","0.002","22.636","0.002","7.7554","0.001","90","","90","","120","","3441.4","0.6","301","1","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H21 La O6 -","- C27 H21 La O6 -","- C162 H126 La6 O36 -","6","0.333333","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.031","","","","0.034","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212395","22.646","0.002","22.646","0.002","7.9212","0.0007","90","","90","","120","","3518.1","0.5","301","1","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H21 Ce O6 -","- C27 H21 Ce O6 -","- C162 H126 Ce6 O36 -","6","0.333333","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.018","","","","0.021","","","","","","1.006","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212396","22.657","0.003","22.657","0.003","7.83","0.001","90","","90","","120","","3480.9","0.8","301","1","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H21 Nd O6 -","- C27 H21 Nd O6 -","- C162 H126 Nd6 O36 -","6","0.333333","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.015","","","","0.017","","","","","","1.067","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212397","22.646","0.002","22.646","0.002","7.767","0.0011","90","","90","","120","","3449.6","0.7","301","1","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H21 O6 Sm -","- C27 H21 O6 Sm -","- C162 H126 O36 Sm6 -","6","0.333333","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.015","","","","0.018","","","","","","1.054","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212398","11.589","0.002","7.817","0.002","13.021","0.003","90","","94.354","0.003","90","","1176.2","0.5","301","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H21 Lu O6 -","- C27 H21 Lu O6 -","- C54 H42 Lu2 O12 -","2","1","","Law, Ga-Lai; Wong, Ka-Leung; Lau, Kok-Kin; Lap, Sze-to; Tanner, Peter A.; Kuo, Fonchu; Wong, Wing-Tak","Nonlinear optical activity in dipolar organic‒lanthanide complexes","Journal of Materials Chemistry","2010","20","20","4074","","10.1039/b926376d","","","0.71073","MoKα","","","0.033","","","","0.041","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212430","40.541","0.006","7.3556","0.0011","23.412","0.003","90","","123.363","0.002","90","","5831","1.4","293","2","293","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C41 H30 -","- C41 H30 -","- C328 H240 -","8","1","","Xia, Zhen-Yuan; Zhang, Zhi-Yun; Su, Jian-Hua; Zhang, Qiong; Fung, Ka-Man; Lam, Mei-Ki; Li, King-Fai; Wong, Wai-Yeung; Cheah, Kok-Wai; Tian, He; Chen, Chin H.","Robust and highly efficient blue light-emitting hosts based on indene-substituted anthracene","Journal of Materials Chemistry","2010","20","18","3768","","10.1039/c000092b","","","0.71073","MoKα","","0.1037","0.0526","","","0.1312","0.1554","","","","","","1.025","","","","has coordinates","180455","2020-10-21","18:00:00",""
"7212912","22.008","0.0002","9.983","0.0001","28.178","0.0003","90","","93.433","0.001","90","","6179.76","0.11","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C98.25 H36 N3 O1.5 S0.25 -","- C98.25 H36 N3 O1.5 S0.25 -","- C393 H144 N12 O6 S -","4","1","","Chiang, Long Y.; Padmawar, Prashant A.; Rogers-Haley, Joy E; So, Grace; Canteenwala, Taizoon; Thota, Sammaiah; Tan, Loon-Seng; Pritzker, Kenneth; Huang, Ying-Ying; Sharma, Sulbha K.; Kurup, Divya Balachandran; Hamblin, Michael R.; Wilson, Brian; Urbas, Augustine","Synthesis and characterization of highly photoresponsive fullerenyl dyads with a close chromophore antenna-C(60) contact and effective photodynamic potential.","Journal of materials chemistry","2010","20","25","5280","5293","10.1039/C0JM00037J","","","0.71073","MoKα","","0.1488","0.0831","","0.2336","0.1932","","","","1.098","1.26","1.26","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212913","10.704","0.002","24.232","0.006","10.425","0.002","99.45","0.01","93.663","0.008","95.382","0.007","2646.9","1","109.1","","109.1","","","","","","","","","5","P -1","-P 1","2","","","","- C76 H39 Fe N11 O4 -","- C76 H39 Fe N11 O4 -","- C152 H78 Fe2 N22 O8 -","2","1","","Ishikawa, Manabu; Asari, Takehiro; Matsuda, Masaki; Tajima, Hiroyuki; Hanasaki, Noriaki; Naito, Toshio; Inabe, Tamotsu","Giant magnetoresistance response by the π‒d interaction in an axially ligated phthalocyanine conductor with two-dimensional π‒π stacking structure","Journal of Materials Chemistry","2010","20","21","4432","","10.1039/c0jm00161a","","","0.7107","MoKα","","","0.081","","","","0.156","","","","","","1.019","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212914","8.777","0.002","34.912","0.007","6.28","0.001","90","","90.459","0.002","90","","1924.3","0.7","298","2","298","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C16 H19 I N2 -","- C16 H19 I N2 -","- C64 H76 I4 N8 -","4","1","","Nunzi, Francesca; Fantacci, Simona; Cariati, Elena; Tordin, Elisa; Casati, Nicola; Macchi, Piero","Stabilization through p-dimethylaminobenzaldehyde of a new NLO-active phase of [E-4-(4-dimethylaminostyryl)-1-methylpyridinium] iodide: synthesis, structural characterization and theoretical investigation of its electronic properties","Journal of Materials Chemistry","2010","20","36","7652","","10.1039/c0jm00466a","","","0.71069","MoKα","","0.0696","0.0564","","","0.1766","0.1859","","","","","","1.079","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212915","5.831","0.0012","27.153","0.005","8.015","0.003","90","","128.627","0.019","90","","991.4","0.5","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(eta$5!-1-methylcyclopentadienyl)-(eta$2!,eta$2!- cyclohexadiene)-iridium(i)","(η^5^-1-methylcyclopentadienyl)-(η^2^,η^2^-cyclohexadiene)-iridium(i)","","- C12 H15 Ir -","- C12 H15 Ir -","- C48 H60 Ir4 -","4","1","","Hämäläinen, Jani; Hatanpää, Timo; Puukilainen, Esa; Costelle, Leila; Pilvi, Tero; Ritala, Mikko; Leskelä, Markku","(MeCp)Ir(CHD) and molecular oxygen as precursors in atomic layer deposition of iridium","Journal of Materials Chemistry","2010","20","36","7669","","10.1039/c0jm00486c","","","0.71073","MoKα","","0.0584","0.0373","","","0.0763","0.0818","","","","","","1.003","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212916","13.7006","0.0003","16.7642","0.0004","20.2638","0.0005","90","","101.869","0.001","90","","4554.68","0.19","220","2","220","2","","","","","","","Synthesized by the authors. See text","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 N4 O4 S -","- C22 H24 N4 O4 S -","- C176 H192 N32 O32 S8 -","8","2","","Dufresne, Stéphane; Bolduc, Andréanne; Skene, W. G.","Towards materials with reversible oxidation and tuneable colours using heterocyclic conjugated azomethines","Journal of Materials Chemistry","2010","20","23","4861","","10.1039/c0jm00557f","","","1.54178","CuKα","","0.0536","0.0475","","","0.1353","0.141","","","","","","1.075","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212917","12.027","0.002","18.364","0.004","9.757","0.002","90","","96.7","0.03","90","","2140.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 Cd2 N12 O9 -","- C40 H32 Cd2 N12 O9 -","- C80 H64 Cd4 N24 O18 -","2","0.5","","Huang, Shengli; Li, Xiaoxia; Shi, Xianju; Hou, Hongwei; Fan, Yaoting","Structure extending and cation exchange of Cd(ii) and Co(ii) materials compounds inducing fluorescence signal mutation","Journal of Materials Chemistry","2010","20","27","5695","","10.1039/c0jm00605j","","","0.71073","MoKα","","0.0666","0.0552","","","0.1291","0.1409","","","","","","1.203","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212918","9.4783","0.0019","11.429","0.002","17.298","0.004","79.47","0.03","81.33","0.03","83.27","0.03","1813.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H60 Co3 N24 O16 -","- C72 H60 Co3 N24 O16 -","- C72 H60 Co3 N24 O16 -","1","0.5","","Huang, Shengli; Li, Xiaoxia; Shi, Xianju; Hou, Hongwei; Fan, Yaoting","Structure extending and cation exchange of Cd(ii) and Co(ii) materials compounds inducing fluorescence signal mutation","Journal of Materials Chemistry","2010","20","27","5695","","10.1039/c0jm00605j","","","0.71073","MoKα","","0.111","0.072","","","0.1444","0.1625","","","","","","1.068","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212919","11.623","0.0004","14.4659","0.0005","19.0615","0.0007","90","","90","","90","","3204.9","0.2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C40 H35 Ir O2 P2 -","- C40 H35 Ir O2 P2 -","- C160 H140 Ir4 O8 P8 -","4","1","","Hung, Jui-Yi; Lin, Chen-Huey; Chi, Yun; Chung, Min-Wen; Chen, Yi-Ju; Lee, Gene-Hsiang; Chou, Pi-Tai; Chen, Chung-Chia; Wu, Chung-Chih","Phosphorescent Ir(iii) complexes bearing double benzyldiphenylphosphine cyclometalates; strategic synthesis, fundamental and integration for white OLED fabrication","Journal of Materials Chemistry","2010","20","36","7682","","10.1039/c0jm00653j","","","0.71073","MoKα","","0.0215","0.0205","","","0.0411","0.0414","","","","","","0.981","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212920","10.9627","0.0005","11.9508","0.0005","18.5245","0.0008","103.385","0.001","100.342","0.001","105.53","0.001","2198.02","0.17","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H49 Ir N4 P2 -","- C57 H49 Ir N4 P2 -","- C114 H98 Ir2 N8 P4 -","2","1","","Hung, Jui-Yi; Lin, Chen-Huey; Chi, Yun; Chung, Min-Wen; Chen, Yi-Ju; Lee, Gene-Hsiang; Chou, Pi-Tai; Chen, Chung-Chia; Wu, Chung-Chih","Phosphorescent Ir(iii) complexes bearing double benzyldiphenylphosphine cyclometalates; strategic synthesis, fundamental and integration for white OLED fabrication","Journal of Materials Chemistry","2010","20","36","7682","","10.1039/c0jm00653j","","","0.71073","MoKα","","0.036","0.0317","","","0.0696","0.0759","","","","","","1.073","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212921","10.16","0.0017","5.16","0.0009","18.758","0.003","90","","94.687","0.004","90","","980.1","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H20 N2 Pb S4 -","- C18 H20 N2 Pb S4 -","- C36 H40 N4 Pb2 S8 -","2","0.5","","Akhtar, Javeed; Malik, Mohammad Azad; O'Brien, Paul; Helliwell, Madeleine","Controlled synthesis of PbS nanoparticles and the deposition of thin films by Aerosol-Assisted Chemical Vapour Deposition (AACVD)","Journal of Materials Chemistry","2010","20","29","6116","","10.1039/c0jm00830c","","","0.71069","MoKα","","0.0132","0.0129","","","0.0305","0.0306","","","","","","1.073","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212922","3.8834","0.0008","7.5943","0.0015","41.63","0.008","90","","90","","90","","1227.7","0.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H8 S3 -","- C16 H8 S3 -","- C64 H32 S12 -","4","1","","Li, Rongjin; Dong, Huanli; Zhan, Xiaowei; He, Yudong; Li, Hongxiang; Hu, Wenping","Single crystal ribbons and transistors of a solution processed sickle-like fused-ring thienoacene","Journal of Materials Chemistry","2010","20","29","6014","","10.1039/c0jm00963f","","","0.71073","MoKα","","0.0561","0.0413","","","0.1053","0.1304","","","","","","1.165","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212923","11.4858","0.0017","11.4858","0.0017","14.756","0.003","90","","90","","120","","1685.9","0.5","293","2","293","2","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","Mg-MOF-1","","","- C7 H3 Mg N O5 -","- C7 H3 Mg N O5 -","- C42 H18 Mg6 N6 O30 -","6","0.5","","Mallick, Arijit; Saha, Subhadeep; Pachfule, Pradip; Roy, Sudip; Banerjee, Rahul","Selective CO2 and H2 adsorption in a chiral magnesium-based metal organic framework (Mg-MOF) with open metal sites","Journal of Materials Chemistry","2010","20","41","9073","","10.1039/c0jm01125h","","","0.71073","MoKα","","0.0757","0.0752","","","0.2331","0.2337","","","","","","1.237","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212924","7.9273","0.0018","12.057","0.003","20.301","0.004","90","","90","","90","","1940.4","0.8","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Mg-MOF-2","","","- C14 H18 Mg2 N2 O14 -","- C14 H18 Mg2 N2 O14 -","- C56 H72 Mg8 N8 O56 -","4","0.5","","Mallick, Arijit; Saha, Subhadeep; Pachfule, Pradip; Roy, Sudip; Banerjee, Rahul","Selective CO2 and H2 adsorption in a chiral magnesium-based metal organic framework (Mg-MOF) with open metal sites","Journal of Materials Chemistry","2010","20","41","9073","","10.1039/c0jm01125h","","","0.71073","MoKα","","0.0483","0.0461","","","0.1299","0.1324","","","","","","0.816","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212925","4.7904","0.0007","9.2698","0.0014","16.959","0.003","74.549","0.002","89.651","0.002","86.261","0.002","724.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H30 N4 S2 -","- C34 H30 N4 S2 -","- C34 H30 N4 S2 -","1","0.5","","Tian, Hongkun; Deng, Yunfeng; Pan, Feng; Huang, Lizhen; Yan, Donghang; Geng, Yanhou; Wang, Fosong","A feasibly synthesized ladder-type conjugated molecule as the novel high mobility n-type organic semiconductor","Journal of Materials Chemistry","2010","20","37","7998","","10.1039/c0jm01173h","","","0.71073","MoKα","","0.0491","0.0435","","","0.1173","0.1227","","","","","","1.043","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212926","5.1178","0.001","7.8729","0.0013","15.815","0.003","85.153","0.005","88.003","0.004","76.368","0.004","617","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H30 O2 S2 -","- C28 H30 O2 S2 -","- C28 H30 O2 S2 -","1","0.5","","Tian, Hongkun; Deng, Yunfeng; Pan, Feng; Huang, Lizhen; Yan, Donghang; Geng, Yanhou; Wang, Fosong","A feasibly synthesized ladder-type conjugated molecule as the novel high mobility n-type organic semiconductor","Journal of Materials Chemistry","2010","20","37","7998","","10.1039/c0jm01173h","","","0.71073","MoKα","","0.0648","0.0513","","","0.1247","0.1346","","","","","","1.057","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212927","9.3331","0.0011","10.1235","0.0012","10.4203","0.0012","70.577","0.002","74.534","0.002","88.29","0.002","893.02","0.18","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C50 H38 O4 -","- C50 H38 O4 -","- C50 H38 O4 -","1","0.5","","Xia, Zhen-Yuan; Su, Jian-Hua; Wong, Wai-Yeung; Wang, Lei; Cheah, Kok-Wai; Tian, He; Chen, Chin H.","High performance organic light-emitting diodes based on tetra(methoxy)-containing anthracene derivatives as a hole transport and electron-blocking layer","Journal of Materials Chemistry","2010","20","38","8382","","10.1039/c0jm01297a","","","0.71073","MoKα","","0.0601","0.0462","","","0.1204","0.133","","","","","","1.017","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212928","8.187","0.002","21.305","0.006","8.621","0.003","90","","93.215","0.006","90","","1501.3","0.8","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H38 O4 -","- C36 H38 O4 -","- C72 H76 O8 -","2","0.5","","Xia, Zhen-Yuan; Su, Jian-Hua; Wong, Wai-Yeung; Wang, Lei; Cheah, Kok-Wai; Tian, He; Chen, Chin H.","High performance organic light-emitting diodes based on tetra(methoxy)-containing anthracene derivatives as a hole transport and electron-blocking layer","Journal of Materials Chemistry","2010","20","38","8382","","10.1039/c0jm01297a","","","0.71073","MoKα","","0.1283","0.0717","","","0.1797","0.213","","","","","","0.982","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212929","7.439","0.0007","11.964","0.002","7.062","0.0012","90.17","0.014","105.226","0.009","84.984","0.01","604","0.16","298.1","","298.1","","","","","","","","","7","P -1","-P 1","2","","","","- C8 H4 Br1.31 Cl0.19 Cu N2 S4 -","- C8 H4 Br1.31 Cl0.19 Cu N2 S4 -","- C16 H8 Br2.62 Cl0.38 Cu2 N4 S8 -","2","1","","Ichikawa, Shun; Takahashi, Kazuyuki; Matsuda, Masaki; Tajima, Hiroyuki; Mori, Hatsumi","Metallic coordination supramolecule, [Cu(i)Cl0.2Br1.3(pyra-TTF)0.5+]","Journal of Materials Chemistry","2010","20","45","10130","","10.1039/c0jm01318h","","","0.71069","MoKα","","","0.0377","","","","0.0436","","","","","","0.776","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212930","11.508","0.007","13.522","0.007","8.643","0.005","106.62","0.02","93.65","0.02","66.583","0.013","1180.7","1.2","120","","","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H8 Br2.54 Cl0.46 Cu2 N4 S8 -","- C16 H8 Br2.545 Cl0.46 Cu2 N4 S8 -","- C32 H16 Br5.09 Cl0.92 Cu4 N8 S16 -","2","1","","Ichikawa, Shun; Takahashi, Kazuyuki; Matsuda, Masaki; Tajima, Hiroyuki; Mori, Hatsumi","Metallic coordination supramolecule, [Cu(i)Cl0.2Br1.3(pyra-TTF)0.5+]","Journal of Materials Chemistry","2010","20","45","10130","","10.1039/c0jm01318h","","","0.71075","MoKα","","","0.0767","","","","0.0907","","","","","","1.716","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212931","7.4234","0.0017","11.953","0.003","7","0.0016","90.147","0.007","105.932","0.005","85.179","0.006","595","0.2","160","","160","","","","","","","","","7","P -1","-P 1","2","","","","- C8 H4 Br1.3 Cl0.2 Cu N2 S4 -","- C8 H4 Br1.3 Cl0.2 Cu N2 S4 -","- C16 H8 Br2.6 Cl0.4 Cu2 N4 S8 -","2","1","","Ichikawa, Shun; Takahashi, Kazuyuki; Matsuda, Masaki; Tajima, Hiroyuki; Mori, Hatsumi","Metallic coordination supramolecule, [Cu(i)Cl0.2Br1.3(pyra-TTF)0.5+]","Journal of Materials Chemistry","2010","20","45","10130","","10.1039/c0jm01318h","","","0.71075","MoKα","","","0.0422","","","","0.0548","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212932","8.776","0.017","13.2","0.02","10.786","0.019","90","","93.665","0.018","90","","1247","4","293.3","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H4 Br2 Cu N2 S4 -","- C8 H4 Br2 Cu N2 S4 -","- C32 H16 Br8 Cu4 N8 S16 -","4","1","","Ichikawa, Shun; Takahashi, Kazuyuki; Matsuda, Masaki; Tajima, Hiroyuki; Mori, Hatsumi","Metallic coordination supramolecule, [Cu(i)Cl0.2Br1.3(pyra-TTF)0.5+]","Journal of Materials Chemistry","2010","20","45","10130","","10.1039/c0jm01318h","","","0.7107","MoKα","","","0.0607","","","","0.1692","","","","","","1.006","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212933","12.3484","0.0003","12.3484","0.0003","14.3979","0.0005","90","","90","","90","","2195.43","0.11","120","2","120","2","","","","","","","synthesis as described","5","P 4/m n c","-P 4 2n","128","","","","- C8 Ge31.14 N4.16 O84 Si8.86 -","- C8 Ge31.144 N4.16 O84 Si8.856 -","- C8 Ge31.144 N4.16 O84 Si8.856 -","1","0.0625","","Attfield, Martin P.; Al-Ebini, Yousef; Hill, Patrick","One-step synthesis, characterisation and properties of core/shell silicogermanate zeotype crystals","Journal of Materials Chemistry","2010","20","39","8686","","10.1039/c0jm01429j","","x-ray","0.71073","MoKα","","0.0362","0.0242","","","0.0547","0.0614","","","","","","1.124","","","","has coordinates,has disorder","180460","2020-10-21","18:00:00",""
"7212934","8.0402","0.0004","18.326","0.0009","38.1833","0.0018","90","","91.227","0.001","90","","5624.8","0.5","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C76 H46 Cl6 -","- C76 H46 Cl6 -","- C304 H184 Cl24 -","4","1","","Xiao, Jinchong; Divayana, Yoga; Zhang, Qichun; Doung, Hieu M.; Zhang, Hua; Boey, Freddy; Sun, Xiao Wei; Wudl, Fred","Synthesis, structure, and optoelectronic properties of a new twistacene 1,2,3,4,6,13-hexaphenyl-7 : 8,11 : 12-bisbenzo-pentacene","Journal of Materials Chemistry","2010","20","37","8167","","10.1039/c0jm01460e","","","0.71073","MoKα","","0.1233","0.0549","","","0.1019","0.1231","","","","","","1.01","","","","has coordinates,has disorder","180460","2020-10-21","18:00:00",""
"7212935","8.36","0.002","15.485","0.004","17.982","0.005","80.497","0.006","89.859","0.005","82.756","0.006","2277.2","1","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H21 N O4 Pt -","- C28 H21 N O4 Pt -","- C112 H84 N4 O16 Pt4 -","4","2","","Wu, Wanhua; Wu, Wenting; Ji, Shaomin; Guo, Huimin; Song, Peng; Han, Keli; Chi, Lina; Shao, Jingyin; Zhao, Jianzhang","Tuning the emission properties of cyclometalated platinum(II) complexes by intramolecular electron-sink/arylethynylated ligands and its application for enhanced luminescent oxygen sensing","Journal of Materials Chemistry","2010","20","43","9775","","10.1039/c0jm01794a","","","0.71073","MoKα","","0.1397","0.0638","","","0.0916","0.1065","","","","","","0.923","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212936","27.941","0.016","5.004","0.003","41.56","0.02","90","","102.511","0.006","90","","5673","5","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H28 N2 O4 Pt -","- C34 H28 N2 O4 Pt -","- C272 H224 N16 O32 Pt8 -","8","1","","Wu, Wanhua; Wu, Wenting; Ji, Shaomin; Guo, Huimin; Song, Peng; Han, Keli; Chi, Lina; Shao, Jingyin; Zhao, Jianzhang","Tuning the emission properties of cyclometalated platinum(II) complexes by intramolecular electron-sink/arylethynylated ligands and its application for enhanced luminescent oxygen sensing","Journal of Materials Chemistry","2010","20","43","9775","","10.1039/c0jm01794a","","","0.71073","MoKα","","0.1267","0.0798","","","0.1683","0.1827","","","","","","1.046","","","","has coordinates,has disorder","180460","2020-10-21","18:00:00",""
"7212937","12.01","0.001","6.0745","0.0004","15.626","0.002","90","","104.14","0.01","90","","1105.45","0.19","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H14 S6 -","- C24 H14 S6 -","- C48 H28 S12 -","2","1","","Piron, Flavia; Leriche, Philippe; Grosu, Ion; Roncali, Jean","Electropolymerizable 3Dπ-conjugated architectures with ethylenedioxythiophene (EDOT) end-groups as precursors of electroactive conjugated networks","Journal of Materials Chemistry","2010","20","45","10260","","10.1039/c0jm01873b","","x-ray","0.71073","MoKα","","","0.0462","","","","0.1424","","","","","","1.022","","","","has coordinates,has disorder","180460","2020-10-21","18:00:00",""
"7212938","9.2527","0.0013","9.6356","0.0014","13.2935","0.0019","96.214","0.002","110.077","0.002","94.487","0.002","1098.1","0.3","198","","198","","","","","","","","","5","P -1","-P 1","2","TTF diamide","","","- C16 H22 N2 O2 S6 -","- C16 H22 N2 O2 S6 -","- C32 H44 N4 O4 S12 -","2","1","","Ahn, Sejung; Kim, Yukyung; Beak, Seungjae; Ishimoto, Shohei; Enozawa, Hideo; Isomura, Eigo; Hasegawa, Masashi; Iyoda, Masahiko; Park, Yungwoo","Synthesis and electrical conductivity of perchlorate-doped TTF‒diamide nanofibers with double and triple helix structures","Journal of Materials Chemistry","2010","20","48","10817","","10.1039/c0jm02628j","","","0.71073","MoKα","","0.0845","0.057","","","0.156","0.1901","","","","","","1.053","","","","has coordinates,has disorder","180460","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","180460","2020-10-21","18:00:00",""
"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","180460","2020-10-21","18:00:00",""
"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","180460","2020-10-21","18:00:00",""
"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","180460","2020-10-21","18:00:00",""
"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",""
"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",""
"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","206958","2020-10-21","18:00:00",""
"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","180460","2020-10-21","18:00:00",""
"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",""
"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",""
"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","180461","2020-10-21","18:00:00",""
"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",""
"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",""
"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",""
"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","180461","2020-10-21","18:00:00",""
"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","180461","2020-10-21","18:00:00",""
"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","180461","2020-10-21","18:00:00",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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","209478","2020-10-21","18:00:00",""
"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",""
"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","198633","2020-10-21","18:00:00",""
"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",""
"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",""
"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",""
"7213543","44.792","0.003","12.3416","0.0007","20.7246","0.001","90","","114.539","0.002","90","","10421.9","1.1","243","2","243","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H6 Cl5 N0 O15 Zn3 -","- C20 H6 Cl5 O15 Zn3 -","- C160 H48 Cl40 O120 Zn24 -","8","1","","Xue, Ming; Zhang, Zhangjing; Xiang, Shengchang; Jin, Zhao; Liang, Chengdu; Zhu, Guang-Shan; Qiu, Shi-Lun; Chen, Banglin","Selective gas adsorption within a five-connected porous metal‒organic framework","Journal of Materials Chemistry","2010","20","19","3984","","10.1039/b927486c","","","0.71073","MoKα","","0.1013","0.0616","","","0.1296","0.1368","","","","","","1.041","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213544","9.6945","0.0008","3.7498","0.0003","8.6531","0.0007","90","","109.912","0.001","90","","295.76","0.04","296","2","296","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Cu Hf4 Si4 -","- Cu Hf4 Si4 -","- Cu2 Hf8 Si8 -","2","0.25","","Guch, Mykhailo; Assoud, Abdeljalil; Kleinke, Holger","Crystal structure and physical properties of the new silicide Hf4CuSi4 with planar CuSi4 rectangles","Journal of Materials Chemistry","2010","20","21","4356","","10.1039/c0jm00066c","","","0.71073","MoKα","","0.0211","0.0207","","","0.0522","0.0526","","","","","","1.228","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7214192","8.24781","0.00015","8.24781","0.00015","8.24781","0.00015","90","","90","","90","","561.069","0.018","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.88)","","- Li Mn2 O3.884 -","- Li Mn2 O3.892 -","- Li8 Mn16 O31.136 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214193","8.24709","0.00012","8.24709","0.00012","8.24709","0.00012","90","","90","","90","","560.922","0.014","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.89)","","- Li Mn2 O3.892 -","- Li Mn2 O3.884 -","- Li8 Mn16 O31.072 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214194","8.2426","0.00014","8.2426","0.00014","8.2426","0.00014","90","","90","","90","","560.006","0.016","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.92)","","- Li Mn2 O3.92 -","- Li Mn2 O3.92 -","- Li8 Mn16 O31.36 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214195","8.2406","0.00015","8.2406","0.00015","8.2406","0.00015","90","","90","","90","","559.598","0.018","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.96)","","- Li Mn2 O3.96 -","- Li Mn2 O3.96 -","- Li8 Mn16 O31.68 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214196","8.24648","0.00011","8.24648","0.00011","8.24648","0.00011","90","","90","","90","","560.797","0.013","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.93)","","- Li Mn2 O3.928 -","- Li Mn2 O3.928 -","- Li8 Mn16 O31.424 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214197","8.24334","0.00011","8.24334","0.00011","8.24334","0.00011","90","","90","","90","","560.157","0.013","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.912)","","- Li Mn2 O3.912 -","- Li Mn2 O3.912 -","- Li8 Mn16 O31.296 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214198","8.24075","0.00007","8.24075","0.00007","8.24075","0.00007","90","","90","","90","","559.629","0.008","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.94)","","- Li Mn2 O3.944 -","- Li Mn2 O3.944 -","- Li8 Mn16 O31.552 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214199","8.23803","0.00008","8.23803","0.00008","8.23803","0.00008","90","","90","","90","","559.075","0.009","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.96)","","- Li Mn2 O3.96 -","- Li Mn2 O3.96 -","- Li8 Mn16 O31.68 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214200","8.23785","0.00013","8.23785","0.00013","8.23785","0.00013","90","","90","","90","","559.038","0.015","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.98)","","- Li Mn2 O3.984 -","- Li Mn2 O3.984 -","- Li8 Mn16 O31.872 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214201","8.24165","0.00012","8.24165","0.00012","8.24165","0.00012","90","","90","","90","","559.812","0.014","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.96)","","- Li Mn2 O3.96 -","- Li Mn2 O3.956 -","- Li8 Mn16 O31.648 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214202","8.23845","0.00013","8.23845","0.00013","8.23845","0.00013","90","","90","","90","","559.161","0.015","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.02/1.98/3.88)","","- Li1.022 Mn1.978 O3.884 -","- Li1.022 Mn1.978 O3.884 -","- Li8.176 Mn15.824 O31.072 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214203","8.23222","0.00005","8.23222","0.00005","8.23222","0.00005","90","","90","","90","","557.893","0.006","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.04/1.96/3.96)","","- Li1.042 Mn1.958 O3.956 -","- Li1.042 Mn1.958 O3.956 -","- Li8.336 Mn15.664 O31.648 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214204","8.21393","0.00015","8.21393","0.00015","8.21393","0.00015","90","","90","","90","","554.183","0.018","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.09/1.91/3.99)","","- Li1.09 Mn1.91 O3.992 -","- Li1.09 Mn1.91 O3.992 -","- Li8.72 Mn15.28 O31.936 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214205","8.24118","0.0001","8.24118","0.0001","8.24118","0.0001","90","","90","","90","","559.717","0.012","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1/2/3.9)","","- Li Mn2 O3.9 -","- Li Mn2 O3.9 -","- Li8 Mn16 O31.2 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214206","8.24185","0.00007","8.24185","0.00007","8.24185","0.00007","90","","90","","90","","559.853","0.008","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.02/1.98/3.94)","","- Li1.022 Mn1.978 O3.94 -","- Li1.022 Mn1.978 O3.94 -","- Li8.176 Mn15.824 O31.52 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214207","8.22889","0.00011","8.22889","0.00011","8.22889","0.00011","90","","90","","90","","557.216","0.013","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.03/1.97/3.98)","","- Li1.034 Mn1.966 O3.976 -","- Li1.034 Mn1.966 O3.976 -","- Li8.272 Mn15.728 O31.808 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214208","8.21687","0.00012","8.21687","0.00012","8.21687","0.00012","90","","90","","90","","554.778","0.014","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.07/1.93/3.98)","","- Li1.068 Mn1.932 O3.984 -","- Li1.068 Mn1.932 O3.984 -","- Li8.544 Mn15.456 O31.872 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214209","8.21218","0.00005","8.21218","0.00005","8.21218","0.00005","90","","90","","90","","553.829","0.006","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.08/1.92/4)","","- Li1.077 Mn1.923 O4 -","- Li1.077 Mn1.923 O4 -","- Li8.616 Mn15.384 O32 -","8","0.0416667","","Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R.","Synthesis, structure and phase relationship in lithium manganese oxide spinel","Journal of Materials Chemistry","2004","14","","1948","1958","10.1039/b314810f","","","","","","","","","","","","","","","","","","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214210","4.578","0.0002","5.7488","0.0003","2.8054","0.0001","90","","90","","90","","73.833","0.006","","","","","","","","","","","","3","P m n m :2","-P 2c 2a","59","","Lithium Manganese(III) Oxide","","- Li Mn O2 -","- Li Mn O2 -","- Li2 Mn2 O4 -","2","0.25","","Croguennec, L.; Deniard, P.; Brec, R.; Lecerf, A.","Preparation, physical and structural characterization of Li Mn O2 samples with variable cationic disorder","Journal of Materials Chemistry","1995","5","","1919","1925","10.1039/jm9950501919","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214211","4.5809","0.0002","5.7487","0.0004","2.8047","0.0002","90","","90","","90","","73.86","0.008","","","","","","","","","","","","3","P m n m :2","-P 2c 2a","59","","Lithium Manganese(III) Oxide","","- Li Mn O2 -","- Li Mn O2 -","- Li2 Mn2 O4 -","2","0.25","","Croguennec, L.; Deniard, P.; Brec, R.; Lecerf, A.","Preparation, physical and structural characterization of Li Mn O2 samples with variable cationic disorder","Journal of Materials Chemistry","1995","5","","1919","1925","10.1039/jm9950501919","","","","","","0.037","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214212","4.5825","0.0002","5.7526","0.0003","2.8067","0.0001","90","","90","","90","","73.988","0.006","","","","","","","","","","","","3","P m n m :2","-P 2c 2a","59","","Lithium Manganese(III) Oxide","","- Li Mn O2 -","- Li Mn O2 -","- Li2 Mn2 O4 -","2","0.25","","Croguennec, L.; Deniard, P.; Brec, R.; Lecerf, A.","Preparation, physical and structural characterization of Li Mn O2 samples with variable cationic disorder","Journal of Materials Chemistry","1995","5","","1919","1925","10.1039/jm9950501919","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214213","4.5758","0.0001","5.7517","0.0001","2.8062","0.0001","90","","90","","90","","73.855","0.003","","","","","","","","","","","","3","P m n m :2","-P 2c 2a","59","","Lithium Manganese(III) Oxide","","- Li Mn O2 -","- Li Mn O2 -","- Li2 Mn2 O4 -","2","0.25","","Croguennec, L.; Deniard, P.; Brec, R.; Lecerf, A.","Preparation, physical and structural characterization of Li Mn O2 samples with variable cationic disorder","Journal of Materials Chemistry","1995","5","","1919","1925","10.1039/jm9950501919","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214214","4.5752","0.0001","5.7506","0.0001","2.8061","0.0001","90","","90","","90","","73.829","0.003","","","","","","","","","","","","3","P m n m :2","-P 2c 2a","59","","Lithium Manganese(III) Oxide","","- Li Mn O2 -","- Li Mn O2 -","- Li2 Mn2 O4 -","2","0.25","","Croguennec, L.; Deniard, P.; Brec, R.; Lecerf, A.","Preparation, physical and structural characterization of Li Mn O2 samples with variable cationic disorder","Journal of Materials Chemistry","1995","5","","1919","1925","10.1039/jm9950501919","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7214215","4.5771","0.0001","5.7561","0.0002","2.8076","0.0001","90","","90","","90","","73.97","0.004","","","","","","","","","","","","3","P m n m :2","-P 2c 2a","59","","Lithium Manganese(III) Oxide","","- Li Mn O2 -","- Li Mn O2 -","- Li2 Mn2 O4 -","2","0.25","","Croguennec, L.; Deniard, P.; Brec, R.; Lecerf, A.","Preparation, physical and structural characterization of Li Mn O2 samples with variable cationic disorder","Journal of Materials Chemistry","1995","5","","1919","1925","10.1039/jm9950501919","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","201202","2020-10-21","18:00:00",""
"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",""
"7214217","4.963","0.001","4.963","0.001","16.957","0.006","90","","90","","120","","361.72","0.16","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","Magnesium calcite","- C Ca0.94 Mg0.06 O3 -","- C Ca0.94 Mg0.06 O3 -","- C6 Ca5.64 Mg0.36 O18 -","6","0.166667","","Falini, G.; Fermani, S.; Gazzano, M.; Ripamonti, A.","Structure and morphology of synthetic magnesium calcite","Journal of Materials Chemistry","1998","8","","1061","1065","10.1039/a707893e","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214218","4.941","0.002","4.941","0.002","16.854","0.002","90","","90","","120","","356.3","0.2","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Magnesium Calcium Carbonate (.1/.9/1)","Calcite, magnesian","- C Ca0.9 Mg0.1 O3 -","- C Ca0.9 Mg0.1 O3 -","- C6 Ca5.4 Mg0.6 O18 -","6","0.166667","","Althoff, P.L.","Structural refinements of dolomite and a magnesian calcite and implications for dolomite formation in the marine environment","Journal of Materials Chemistry","1977","62","","772","783","","","","","","","0.025","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215083","5.426","0.0005","11.6597","0.0012","6.5013","0.0007","90","","95.256","0.009","90","","409.58","0.07","173","2","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","TKX50, Thomas Klapoetke 50 Year Explosive","Bishydroxylammonium 5,5-1N-oxidotetrazolate","","- C2 H8 N10 O4 -","- C2 H8 N10 O4 -","- C4 H16 N20 O8 -","2","0.5","","Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg","Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate","Journal of Materials Chemistry","2012","22","38","20418","","10.1039/c2jm33646d","","","0.71073","MoKα","","0.0471","0.0334","","","0.0825","0.0856","","","","","","0.969","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215084","5.4872","0.0008","11.5472","0.0015","6.4833","0.0009","90","","95.402","0.012","90","","408.97","0.1","100","2","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","TKX-50","bishydroxylammonium 5,5-bis(1-oxidotetrazolate","","- C2 H8 N10 O4 -","- C2 H8 N10 O4 -","- C4 H16 N20 O8 -","2","0.5","","Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg","Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate","Journal of Materials Chemistry","2012","22","38","20418","","10.1039/c2jm33646d","","","0.71073","MoKα","","0.0427","0.0342","","","0.0818","0.0895","","","","","","1.057","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215085","5.4408","0.0006","11.7514","0.0013","6.5612","0.0009","90","","95.071","0.011","90","","417.86","0.09","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bishydroxylammonium bis-1N-oxidotetrazolate","bishydroxylammonium bis-1N-oxidotetrazolate","","- C2 H8 N10 O4 -","- C2 H8 N10 O4 -","- C4 H16 N20 O8 -","2","0.5","","Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg","Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate","Journal of Materials Chemistry","2012","22","38","20418","","10.1039/c2jm33646d","","","0.71073","MoKα","","0.0469","0.0344","","","0.0835","0.0915","","","","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215086","7.6818","0.001","6.7692","0.0012","18.884","0.003","90","","90","","90","","982","0.3","173","2","173","","","","","","","","","4","P b c a","-P 2ac 2ab","61","5,5-bis(1-hydroxy-tetrazole) dimethanolate","5,5-bis(1-hydroxy-tetrazole) dimethanolate","","- C4 H10 N8 O4 -","- C4 H10 N8 O4 -","- C16 H40 N32 O16 -","4","0.5","","Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg","Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate","Journal of Materials Chemistry","2012","22","38","20418","","10.1039/c2jm33646d","","","0.71073","MoKα","","0.0767","0.0404","","","0.0827","0.0891","","","","","","0.841","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215087","11.66","0.002","8.705","0.0017","18.028","0.003","90","","90","","90","","1829.8","0.6","173","2","173","","","","","","","","","4","P b c a","-P 2ac 2ab","61","dimethylammonium 5-(1-hydroxytetrazolyl)-5-(1-oxidotetrazolate","dimethylammonium 5-(1-hydroxytetrazolyl)-5-(1-oxidotetrazolate","","- C4 H9 N9 O2 -","- C4 H9 N9 O2 -","- C32 H72 N72 O16 -","8","1","","Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg","Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate","Journal of Materials Chemistry","2012","22","38","20418","","10.1039/c2jm33646d","","","0.71073","MoKα","","0.0706","0.0437","","","0.0993","0.1201","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215088","7.7443","0.0003","6.2459","0.0003","8.7","0.0003","90","","116.052","0.002","90","","378.06","0.03","173","2","173","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","5,5-bis(1-hydroxy-tetrazole) dihydrate","5,5-bis(1-hydroxy-tetrazole) dihydrate","","- C2 H6 N8 O4 -","- C2 H6 N8 O4 -","- C4 H12 N16 O8 -","2","0.25","","Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg","Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate","Journal of Materials Chemistry","2012","22","38","20418","","10.1039/c2jm33646d","","","0.71073","MoKα","","0.0467","0.0458","","","0.1422","0.1431","","","","","","1.217","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215089","10.9439","0.0006","13.7898","0.0007","14.4698","0.0007","101.357","0.004","99.878","0.004","97.211","0.004","2080.32","0.19","173","0.14","173","0.14","","","","","","","","4","P -1","-P 1","2","","","","- C54 H46 O Si -","- C54 H46 O Si -","- C108 H92 O2 Si2 -","2","1","","Jiang, Tao; Jiang, Yibing; Qin, Wei; Chen, Shuming; Lu, Yahong; Lam, Jacky W. Y.; He, Bairong; Lu, Ping; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Hoi Sing; Zhao, Zujin; Qiu, Huayu; Tang, Ben Zhong","Naphthalene-substituted 2,3,4,5-tetraphenylsiloles: synthesis, structure, aggregation-induced emission and efficient electroluminescence","Journal of Materials Chemistry","2012","22","38","20266","","10.1039/c2jm34621d","","x-ray","1.5418","CuKα","","0.0787","0.067","","","0.1726","0.1828","","","","","","1.017","","","","has coordinates,has disorder","180481","2020-10-21","18:00:00",""
"7215090","25.5955","0.0003","10.439","0.0001","13.5467","0.0001","90","","90.954","0.001","90","","3619.06","0.06","173","0.14","173","0.14","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C50 H38 Si -","- C50 H38 Si -","- C200 H152 Si4 -","4","1","","Jiang, Tao; Jiang, Yibing; Qin, Wei; Chen, Shuming; Lu, Yahong; Lam, Jacky W. Y.; He, Bairong; Lu, Ping; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Hoi Sing; Zhao, Zujin; Qiu, Huayu; Tang, Ben Zhong","Naphthalene-substituted 2,3,4,5-tetraphenylsiloles: synthesis, structure, aggregation-induced emission and efficient electroluminescence","Journal of Materials Chemistry","2012","22","38","20266","","10.1039/c2jm34621d","","x-ray","1.5418","CuKα","","0.0421","0.0363","","","0.1002","0.1041","","","","","","1.013","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215091","20.6335","0.0019","14.6119","0.0013","9.6084","0.0009","90","","103.327","0.002","90","","2818.9","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H28 Br2 O Si -","- C31 H28 Br2 O Si -","- C124 H112 Br8 O4 Si4 -","4","1","","Jiang, Tao; Jiang, Yibing; Qin, Wei; Chen, Shuming; Lu, Yahong; Lam, Jacky W. Y.; He, Bairong; Lu, Ping; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Hoi Sing; Zhao, Zujin; Qiu, Huayu; Tang, Ben Zhong","Naphthalene-substituted 2,3,4,5-tetraphenylsiloles: synthesis, structure, aggregation-induced emission and efficient electroluminescence","Journal of Materials Chemistry","2012","22","38","20266","","10.1039/c2jm34621d","","","0.71073","MoKα","","0.0987","0.0498","","","0.1464","0.1756","","","","","","1.016","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215092","16.4393","0.0003","16.4393","0.0003","23.777","0.0009","90","","90","","120","","5564.9","0.3","296","2","296","2","","","","","","","","4","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C27 H17 O7 Pr -","- C27 H15 O7 Pr -","- C162 H90 O42 Pr6 -","6","0.5","","Lin, Zhongjun; Zou, Ruqiang; Xia, Wei; Chen, Liangjie; Wang, Xidong; Liao, Fuhui; Wang, Yingxia; Lin, Jianhua; Burrell, Anthony K.","Ultrasensitive sorption behavior of isostructural lanthanide‒organic frameworks induced by lanthanide contraction","Journal of Materials Chemistry","2012","22","39","21076","","10.1039/c2jm33884j","","","0.71073","MoKα","","0.0452","0.0353","","","0.0899","0.0934","","","","","","0.983","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215093","16.4393","0.0003","16.4393","0.0003","23.777","0.0009","90","","90","","120","","5564.9","0.3","296","2","296","2","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C33 H31 N2 O9 Pr -","- C33 H15 N2 O9 Pr -","- C198 H90 N12 O54 Pr6 -","6","0.5","","Lin, Zhongjun; Zou, Ruqiang; Xia, Wei; Chen, Liangjie; Wang, Xidong; Liao, Fuhui; Wang, Yingxia; Lin, Jianhua; Burrell, Anthony K.","Ultrasensitive sorption behavior of isostructural lanthanide‒organic frameworks induced by lanthanide contraction","Journal of Materials Chemistry","2012","22","39","21076","","10.1039/c2jm33884j","","","0.71073","MoKα","","0.0897","0.0707","","","0.1949","0.2072","","","","","","1.443","","","","has coordinates,has disorder","180481","2020-10-21","18:00:00",""
"7215094","10.849","0.003","14.172","0.005","20.208","0.007","86.734","0.007","83.852","0.009","79.093","0.007","3031.2","1.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H43 Eu4 N2 O32 -","- C54 H43 Eu4 N2 O32 -","- C108 H86 Eu8 N4 O64 -","2","1","","Zhang, Huabin; Zhou, Liujiang; Wei, Jing; Li, Zhihua; Lin, Ping; Du, Shaowu","Highly luminescent and thermostable lanthanide-carboxylate framework materials with helical configurations","Journal of Materials Chemistry","2012","22","39","21210","","10.1039/c2jm34088g","","","0.71073","MoKα","","0.0435","0.0381","","","0.08","0.082","","","","","","0.994","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215095","10.836","0.003","14.156","0.004","20.139","0.005","86.706","0.007","83.875","0.007","78.99","0.004","3012.9","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H40 Gd4 N2 O32 -","- C54 H40 Gd4 N2 O32 -","- C108 H80 Gd8 N4 O64 -","2","1","","Zhang, Huabin; Zhou, Liujiang; Wei, Jing; Li, Zhihua; Lin, Ping; Du, Shaowu","Highly luminescent and thermostable lanthanide-carboxylate framework materials with helical configurations","Journal of Materials Chemistry","2012","22","39","21210","","10.1039/c2jm34088g","","","0.71073","MoKα","","0.0392","0.0339","","","0.0834","0.0887","","","","","","0.98","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215096","10.85","0.004","14.135","0.005","20.084","0.007","86.494","0.009","83.743","0.007","78.839","0.008","3001.4","1.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H40 N2 O32 Tb4 -","- C54 H40 N2 O32 Tb4 -","- C108 H80 N4 O64 Tb8 -","2","1","","Zhang, Huabin; Zhou, Liujiang; Wei, Jing; Li, Zhihua; Lin, Ping; Du, Shaowu","Highly luminescent and thermostable lanthanide-carboxylate framework materials with helical configurations","Journal of Materials Chemistry","2012","22","39","21210","","10.1039/c2jm34088g","","","0.71073","MoKα","","0.0472","0.0404","","","0.1017","0.1088","","","","","","1.057","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215097","27.088","0.0013","27.088","0.0013","41.255","0.0014","90","0.001","90","0.001","90","0.001","30271","2","293","2","293","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- H344 Mn40 Mo96 Na24 O634 P68 -","- Mn40 Mo96 Na24 O634 P68 -","- Mn80 Mo192 Na48 O1268 P136 -","2","0.0625","","Du, Dong-Ying; Qin, Jun-Sheng; Wang, Chun-Gang; Liu, Xian-Chun; Li, Shun-Li; Su, Zhong-Min; Wang, Xin-Long; Lan, Ya-Qian; Wang, En-Bo","Redox-active polyoxometalate-based crystalline material-immobilized noble metal nanoparticles: spontaneous reduction and synergistic catalytic activity","Journal of Materials Chemistry","2012","22","39","21040","","10.1039/c2jm33959e","","","0.71069","MoKα","","0.0574","0.0451","","","0.1305","0.1393","","","","","","1.075","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215098","16.682","0.003","6.2944","0.0013","21.713","0.004","90","","105.56","0.03","90","","2196.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H18 F2 N2 O Pt -","- C28 H18 F2 N2 O Pt -","- C112 H72 F8 N8 O4 Pt4 -","4","1","","Liu, Shujuan; Sun, Huibin; Ma, Yun; Ye, Shanghui; Liu, Xiangmei; Zhou, Xinhui; Mou, Xin; Wang, Lianhui; Zhao, Qiang; Huang, Wei","Rational design of metallophosphors with tunable aggregation-induced phosphorescent emission and their promising applications in time-resolved luminescence assay and targeted luminescence imaging of cancer cells","Journal of Materials Chemistry","2012","22","41","22167","","10.1039/c2jm34512a","","","0.71073","MoKα","","0.0634","0.0452","","","0.0848","0.0907","","","","","","1.221","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215099","20.828","0.004","6.0006","0.0012","15.175","0.003","90","","99.82","0.03","90","","1868.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 N2 O Pt -","- C24 H18 N2 O Pt -","- C96 H72 N8 O4 Pt4 -","4","1","","Liu, Shujuan; Sun, Huibin; Ma, Yun; Ye, Shanghui; Liu, Xiangmei; Zhou, Xinhui; Mou, Xin; Wang, Lianhui; Zhao, Qiang; Huang, Wei","Rational design of metallophosphors with tunable aggregation-induced phosphorescent emission and their promising applications in time-resolved luminescence assay and targeted luminescence imaging of cancer cells","Journal of Materials Chemistry","2012","22","41","22167","","10.1039/c2jm34512a","","","0.71073","MoKα","","0.0402","0.0293","","","0.0518","0.0551","","","","","","1.037","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215100","19.293","0.009","6.181","0.003","17.682","0.008","90","","93.298","0.006","90","","2105.1","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 N2 O Pt -","- C28 H20 N2 O Pt -","- C112 H80 N8 O4 Pt4 -","4","1","","Liu, Shujuan; Sun, Huibin; Ma, Yun; Ye, Shanghui; Liu, Xiangmei; Zhou, Xinhui; Mou, Xin; Wang, Lianhui; Zhao, Qiang; Huang, Wei","Rational design of metallophosphors with tunable aggregation-induced phosphorescent emission and their promising applications in time-resolved luminescence assay and targeted luminescence imaging of cancer cells","Journal of Materials Chemistry","2012","22","41","22167","","10.1039/c2jm34512a","","","0.71073","MoKα","","0.0509","0.0353","","","0.0747","0.0791","","","","","","0.893","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215101","9.5801","0.0007","8.9412","0.0006","11.6254","0.0008","90","","114.221","0.001","90","","908.14","0.11","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H20 N2 O Pt -","- C21 H20 N2 O Pt -","- C42 H40 N4 O2 Pt2 -","2","1","","Liu, Shujuan; Sun, Huibin; Ma, Yun; Ye, Shanghui; Liu, Xiangmei; Zhou, Xinhui; Mou, Xin; Wang, Lianhui; Zhao, Qiang; Huang, Wei","Rational design of metallophosphors with tunable aggregation-induced phosphorescent emission and their promising applications in time-resolved luminescence assay and targeted luminescence imaging of cancer cells","Journal of Materials Chemistry","2012","22","41","22167","","10.1039/c2jm34512a","","","0.71073","MoKα","","0.0427","0.0341","","","0.0682","0.0796","","","","","","1.101","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215102","8.8439","0.0008","29.671","0.003","8.2022","0.0008","90","","101.712","0.002","90","","2107.5","0.4","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 N2 O Pt -","- C28 H20 N2 O Pt -","- C112 H80 N8 O4 Pt4 -","4","1","","Liu, Shujuan; Sun, Huibin; Ma, Yun; Ye, Shanghui; Liu, Xiangmei; Zhou, Xinhui; Mou, Xin; Wang, Lianhui; Zhao, Qiang; Huang, Wei","Rational design of metallophosphors with tunable aggregation-induced phosphorescent emission and their promising applications in time-resolved luminescence assay and targeted luminescence imaging of cancer cells","Journal of Materials Chemistry","2012","22","41","22167","","10.1039/c2jm34512a","","","0.71073","MoKα","","0.0473","0.0399","","","0.0929","0.0962","","","","","","1.039","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215103","9.1882","0.0018","10.6127","0.0017","10.872","0.0017","97.965","0.003","110.138","0.003","111.785","0.003","880.1","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H21 N3 O6 -","- C16 H21 N3 O6 -","- C32 H42 N6 O12 -","2","1","","Maity, Suman Kumar; Kumar, Ravi; Ambast, Deepak K. S.; Pal, Bipul; Haldar, Debasish","Self-assembly and nonlinear optical properties of a synthetic dipeptide","Journal of Materials Chemistry","2012","22","41","22198","","10.1039/c2jm34338j","","","0.71073","MoKα","","0.1028","0.0699","","","0.1954","0.2226","","","","","","1.073","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215104","4.9118","0.0007","12.8431","0.0018","27.493","0.004","90","","90","","90","","1734.3","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 N2 O6 -","- C18 H18 N2 O6 -","- C72 H72 N8 O24 -","4","1","","Maity, Suman Kumar; Kumar, Ravi; Ambast, Deepak K. S.; Pal, Bipul; Haldar, Debasish","Self-assembly and nonlinear optical properties of a synthetic dipeptide","Journal of Materials Chemistry","2012","22","41","22198","","10.1039/c2jm34338j","","","0.71073","MoKα","","0.0583","0.0393","","","0.0985","0.1144","","","","","","0.98","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215105","7.102","0.002","10.781","0.003","12.643","0.004","100.98","0.005","100.11","0.004","92.151","0.003","933","0.5","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H16 N22 O3 -","- C8 H16 N22 O3 -","- C16 H32 N44 O6 -","2","1","","Liang, Lixuan; Huang, Haifeng; Wang, Kai; Bian, Chengming; Song, Jinhong; Ling, Liming; Zhao, Fengqi; Zhou, Zhiming","Oxy-bridged bis(1H-tetrazol-5-yl)furazan and its energetic salts paired with nitrogen-rich cations: highly thermally stable energetic materials with low sensitivity","Journal of Materials Chemistry","2012","22","41","21954","","10.1039/c2jm33873d","","","0.71073","MoKα","","0.0595","0.0406","","","0.0822","0.0882","","","","","","0.999","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215106","12.2118","0.001","9.2324","0.0005","13.7527","0.0014","90","","114.505","0.004","90","","1410.9","0.2","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H18 N28 O11 -","- C13 H18 N28 O11 -","- C26 H36 N56 O22 -","2","1","","Liang, Lixuan; Huang, Haifeng; Wang, Kai; Bian, Chengming; Song, Jinhong; Ling, Liming; Zhao, Fengqi; Zhou, Zhiming","Oxy-bridged bis(1H-tetrazol-5-yl)furazan and its energetic salts paired with nitrogen-rich cations: highly thermally stable energetic materials with low sensitivity","Journal of Materials Chemistry","2012","22","41","21954","","10.1039/c2jm33873d","","","0.71073","MoKα","","0.0442","0.037","","","0.0829","0.0866","","","","","","1.002","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215107","10.223","0.004","12.234","0.004","14.849","0.005","90","","107.163","0.004","90","","1774.4","1.1","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H14 N20 O3 -","- C8 H14 N20 O3 -","- C32 H56 N80 O12 -","4","0.5","","Liang, Lixuan; Huang, Haifeng; Wang, Kai; Bian, Chengming; Song, Jinhong; Ling, Liming; Zhao, Fengqi; Zhou, Zhiming","Oxy-bridged bis(1H-tetrazol-5-yl)furazan and its energetic salts paired with nitrogen-rich cations: highly thermally stable energetic materials with low sensitivity","Journal of Materials Chemistry","2012","22","41","21954","","10.1039/c2jm33873d","","","0.71073","MoKα","","0.0642","0.0423","","","0.0907","0.0997","","","","","","0.999","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215108","10.489","0.006","11.018","0.006","15.197","0.008","90","","109.451","0.007","90","","1656","1.6","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H12 N18 O3 -","- C8 H12 N18 O3 -","- C32 H48 N72 O12 -","4","0.5","","Liang, Lixuan; Huang, Haifeng; Wang, Kai; Bian, Chengming; Song, Jinhong; Ling, Liming; Zhao, Fengqi; Zhou, Zhiming","Oxy-bridged bis(1H-tetrazol-5-yl)furazan and its energetic salts paired with nitrogen-rich cations: highly thermally stable energetic materials with low sensitivity","Journal of Materials Chemistry","2012","22","41","21954","","10.1039/c2jm33873d","","","0.71073","MoKα","","0.0682","0.0447","","","0.0914","0.0986","","","","","","1.001","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215109","13.204","0.002","10.4398","0.0015","21.992","0.003","90","","99.421","0.002","90","","2990.6","0.7","185","2","185","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H64 Cl4 N2 O12 P4 -","- C54 H64 Cl4 N2 O12 P4 -","- C108 H128 Cl8 N4 O24 P8 -","2","0.5","","Chen, Bo; Ding, Junqiao; Wang, Lixiang; Jing, Xiabin; Wang, Fosong","Phosphonate substituted 4,4′-bis(N-carbazolyl)biphenyl with dominant electron injection/transport ability for tuning the single-layer device performance of self-host phosphorescent dendrimer","Journal of Materials Chemistry","2012","22","44","23680","","10.1039/c2jm35526d","","","0.71073","MoKα","","0.0851","0.0625","","","0.1601","0.1772","","","","","","1.008","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215110","12.983","0.004","17.325","0.005","25.312","0.007","106.99","0.005","97.554","0.005","105.072","0.005","5123","3","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C256 H272 N6 -","- C256 H272 N6 -","- C256 H272 N6 -","1","0.5","","Zou, Yang; Ye, Tengling; Ma, Dongge; Qin, Jingui; Yang, Chuluo","Star-shaped hexakis(9,9-dihexyl-9H-fluoren-2-yl)benzene end-capped with carbazole and diphenylamine units: solution-processable, high Tg hole-transporting materials for organic light-emitting devices","Journal of Materials Chemistry","2012","22","44","23485","","10.1039/c2jm35618j","","","0.71073","MoKα","","0.1385","0.1047","","","0.2995","0.3382","","","","","","1.331","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215111","17.37","0.002","17.5261","0.0019","19.152","0.002","111.516","0.002","95.702","0.002","104.294","0.002","5138.3","1","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C256 H284 N6 -","- C256 H284 N6 -","- C256 H284 N6 -","1","0.5","","Zou, Yang; Ye, Tengling; Ma, Dongge; Qin, Jingui; Yang, Chuluo","Star-shaped hexakis(9,9-dihexyl-9H-fluoren-2-yl)benzene end-capped with carbazole and diphenylamine units: solution-processable, high Tg hole-transporting materials for organic light-emitting devices","Journal of Materials Chemistry","2012","22","44","23485","","10.1039/c2jm35618j","","","0.71073","MoKα","","0.1729","0.1317","","","0.3724","0.4097","","","","","","1.551","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215112","24.373","0.006","11.367","0.003","36.596","0.01","90","","97.685","0.004","90","","10048","5","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C71 H79 Cd3 N5 O26 -","- C67 H54 Cd3 N5 O26 -","- C268 H216 Cd12 N20 O104 -","4","1","","Yi, Fei-Yan; Yang, Weiting; Sun, Zhong-Ming","Highly selective acetone fluorescent sensors based on microporous Cd(ii) metal‒organic frameworks","Journal of Materials Chemistry","2012","22","43","23201","","10.1039/c2jm35273g","","","0.71073","MoKα","","0.1072","0.0775","","","0.225","0.2469","","","","","","1.041","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215113","29.766","0.006","20.293","0.005","16.483","0.004","90","","111.107","0.004","90","","9288","4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C64 H50 Cd3 N4 O19 -","- C64 H50 Cd3 N4 O19 -","- C256 H200 Cd12 N16 O76 -","4","0.5","","Yi, Fei-Yan; Yang, Weiting; Sun, Zhong-Ming","Highly selective acetone fluorescent sensors based on microporous Cd(ii) metal‒organic frameworks","Journal of Materials Chemistry","2012","22","43","23201","","10.1039/c2jm35273g","","","0.71073","MoKα","","0.1379","0.0764","","","0.2144","0.2603","","","","","","1.011","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215114","4.328","0.004","19.117","0.016","13.181","0.01","90","","90","","90","","1090.6","1.6","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- Ba2 Bi In Se5 -","- Ba2 Bi In Se5 -","- Ba8 Bi4 In4 Se20 -","4","0.5","","Lin, Chen-Sheng; Luo, Zhong-Zhen; Cheng, Wen-Dan; Zhang, Hao; Zhang, Wei-Long","Design of SHG materials with mid-infrared transparency based on genetic engineering for Ba2BiInA5 (A = Se, Te)","Journal of Materials Chemistry","2012","22","40","21713","","10.1039/c2jm34775j","","","0.71073","MoKα","","0.0411","0.0297","","","0.0506","0.0547","","","","","","0.648","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215115","34.569","0.003","17.656","0.002","20.504","0.002","90","","108.326","0.003","90","","11880","2","291","2","291","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C26 H19.2 Mn N5 O4.1 -","- C26 H19.2 Mn N5 O4.1 -","- C520 H384 Mn20 N100 O82 -","20","5","","Wen, Lili; Zhou, Li; Zhang, Bingguang; Meng, Xianggao; Qu, Hua; Li, Dongfeng","Multifunctional amino-decorated metal‒organic frameworks: nonlinear-optic, ferroelectric, fluorescence sensing and photocatalytic properties","Journal of Materials Chemistry","2012","22","42","22603","","10.1039/c2jm34349e","","","0.71073","MoKα","","0.0733","0.057","","","0.1299","0.1342","","","","","","1.047","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215116","20.661","0.004","11.567","0.002","14.227","0.003","90","","116.01","0.03","90","","3055.7","1.3","291","2","291","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C28 H33 N7 O6 Zn -","- C28 H33 N7 O6 Zn -","- C112 H132 N28 O24 Zn4 -","4","1","","Wen, Lili; Zhou, Li; Zhang, Bingguang; Meng, Xianggao; Qu, Hua; Li, Dongfeng","Multifunctional amino-decorated metal‒organic frameworks: nonlinear-optic, ferroelectric, fluorescence sensing and photocatalytic properties","Journal of Materials Chemistry","2012","22","42","22603","","10.1039/c2jm34349e","","","0.71073","MoKα","","0.0714","0.0587","","","0.1292","0.1331","","","","","","1.09","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215117","20.96","0.004","11.53","0.002","14.211","0.003","90","","116.24","0.03","90","","3080.4","1.3","291","2","291","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C26 H30 Co N6 O6 -","- C26 H30 Co N6 O6 -","- C104 H120 Co4 N24 O24 -","4","1","","Wen, Lili; Zhou, Li; Zhang, Bingguang; Meng, Xianggao; Qu, Hua; Li, Dongfeng","Multifunctional amino-decorated metal‒organic frameworks: nonlinear-optic, ferroelectric, fluorescence sensing and photocatalytic properties","Journal of Materials Chemistry","2012","22","42","22603","","10.1039/c2jm34349e","","","0.71073","MoKα","","0.0759","0.0526","","","0.1022","0.1058","","","","","","1.076","","","","has coordinates,has disorder","180482","2020-10-21","18:00:00",""
"7215118","11.7678","0.0014","17.166","0.002","19.269","0.002","90","","90","","90","","3892.5","0.8","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H19 Co N3 O4 -","- C21 H19 Co N3 O4 -","- C168 H152 Co8 N24 O32 -","8","1","","Wen, Lili; Zhou, Li; Zhang, Bingguang; Meng, Xianggao; Qu, Hua; Li, Dongfeng","Multifunctional amino-decorated metal‒organic frameworks: nonlinear-optic, ferroelectric, fluorescence sensing and photocatalytic properties","Journal of Materials Chemistry","2012","22","42","22603","","10.1039/c2jm34349e","","","0.71073","MoKα","","0.0891","0.0395","","","0.0841","0.0942","","","","","","1","","","","has coordinates,has disorder","180482","2020-10-21","18:00:00",""
"7215447","8.9981","0.00024","8.05617","0.00021","11.7678","0.00026","90","","90","","90","","853.05","0.04","298","","298","","","","","","","","","4","C m c 21","C 2c -2","36","","","","- B4 Ca3 D12 O3 -","- B4 Ca3 D12 O3 -","- B16 Ca12 D48 O12 -","4","0.5","","Riktor, M. D.; Filinchuk, Y.; Vajeeston, P.; Bardají, E. G.; Fichtner, M.; Fjellvåg, H.; Sørby, M. H.; Hauback, B. C.","The crystal structure of the first borohydride borate, Ca3(BD4)3(BO3)","Journal of Materials Chemistry","2011","21","20","7188","","10.1039/c1jm00074h","powder diffraction","","","","","","","","","","","","","72.44","","","","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215495","9.2754","0.0015","11.6067","0.0019","14.374","0.002","80.407","0.002","87.018","0.002","88.813","0.002","1523.6","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H36 O2 S5 -","- C30 H36 O2 S5 -","- C60 H72 O4 S10 -","2","1","","Santato, Clara; Favaretto, Laura; Melucci, Manuela; Zanelli, Alberto; Gazzano, Massimo; Monari, Magda; Isik, Dilek; Banville, David; Bertolazzi, Simone; Loranger, Sébastien; Cicoira, Fabio","Influence of the oxidation level on the electronic, morphological and charge transport properties of novel dithienothiophene S-oxide and S,S-dioxide inner core oligomers","Journal of Materials Chemistry","2010","20","4","669","","10.1039/b917587c","","","0.71073","MoKα","","0.1439","0.0604","","","0.1481","0.1924","","","","","","1.003","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215496","12.8694","0.0002","15.067","0.0003","22.1339","0.0004","90","","91.469","0.001","90","","4290.42","0.13","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","BaCo(cdta)-5H2O","","","- C14 H28 Ba Co N2 O13 -","- C14 H28 Ba Co N2 O13 -","- C112 H224 Ba8 Co8 N16 O104 -","8","1","","Bulimestru, Ion; Mentré, Olivier; Tancret, Nathalie; Rolle, Aurélie; Djelal, Nora; Burylo, Laurence; Cornei, Nicoleta; Popa, Nelea; Gulea, Aurelian","Heterobimetallic Ba‒Co aminopolycarboxylate complexes as precursors for BaCoO3-δ oxides; towards a one-stage-deposition of cobaltite films","Journal of Materials Chemistry","2010","20","47","10724","","10.1039/c0jm01012j","","","0.71073","MoKα","","0.0318","0.0264","","","0.0711","0.0736","","","","","","1.093","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215497","9.5979","0.0003","9.6686","0.0003","9.7505","0.0003","64.982","0.001","60.779","0.001","64.623","0.001","686.79","0.04","296","2","296","2","","","","","","","","6","P -1","-P 1","2","BaCo(nta)CH3COO-2H2O","","","- C8 H13 Ba Co N O10 -","- C8 H13 Ba Co N O10 -","- C16 H26 Ba2 Co2 N2 O20 -","2","1","","Bulimestru, Ion; Mentré, Olivier; Tancret, Nathalie; Rolle, Aurélie; Djelal, Nora; Burylo, Laurence; Cornei, Nicoleta; Popa, Nelea; Gulea, Aurelian","Heterobimetallic Ba‒Co aminopolycarboxylate complexes as precursors for BaCoO3-δ oxides; towards a one-stage-deposition of cobaltite films","Journal of Materials Chemistry","2010","20","47","10724","","10.1039/c0jm01012j","","","0.71073","MoKα","","0.0215","0.0188","","","0.052","0.0536","","","","","","0.961","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215498","15.0633","0.0003","14.5216","0.0003","21.9097","0.0005","90","","95.005","0.008","90","","4774.32","0.18","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C38 H42 Cl2 Cu2 N10 O15 -","- C38 H42 Cl2 Cu2 N10 O15 -","- C152 H168 Cl8 Cu8 N40 O60 -","4","1","","Kolotilov, Sergey V.; Cador, Olivier; Pointillart, Fabrice; Golhen, Stéphane; Le Gal, Yann; Gavrilenko, Konstantin S.; Ouahab, Lahcène","A new approach towards ferromagnetic conducting materials based on TTF-containing polynuclear complexes","Journal of Materials Chemistry","2010","20","42","9505","","10.1039/b925178b","","","0.71073","MoKα","","0.1197","0.077","","","0.2247","0.2594","","","","","","1.028","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215637","8.5069","0.001","9.9764","0.0014","15.946","0.002","87.271","0.009","79.544","0.009","65.359","0.01","1209.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H35 I N2 O2 -","- C22 H35 I N2 O2 -","- C44 H70 I2 N4 O4 -","2","1","","Hao, Fuying; Zhang, Xuanjun; Tian, Yupeng; Zhou, Hongping; Li, Lin; Wu, Jieying; Zhang, Shengyi; Yang, Jiaxiang; Jin, Baokang; Tao, Xutang; Zhou, Guangyong; Jiang, Minhua","Design, crystal structures and enhanced frequency-upconverted lasing efficiencies of a new series of dyes from hybrid of inorganic polymers and organic chromophores","Journal of Materials Chemistry","2009","19","48","9163","","10.1039/b914656c","","","0.71073","MoKα","","0.0636","0.0438","","","0.1118","0.1258","","","","","","0.932","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215638","15.0256","0.0012","8.8242","0.001","17.4227","0.0018","90","","115.336","0.006","90","","2087.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H29 I N2 O -","- C20 H29 I N2 O -","- C80 H116 I4 N8 O4 -","4","1","","Hao, Fuying; Zhang, Xuanjun; Tian, Yupeng; Zhou, Hongping; Li, Lin; Wu, Jieying; Zhang, Shengyi; Yang, Jiaxiang; Jin, Baokang; Tao, Xutang; Zhou, Guangyong; Jiang, Minhua","Design, crystal structures and enhanced frequency-upconverted lasing efficiencies of a new series of dyes from hybrid of inorganic polymers and organic chromophores","Journal of Materials Chemistry","2009","19","48","9163","","10.1039/b914656c","","","0.71073","MoKα","","0.0577","0.0345","","","0.0701","0.0784","","","","","","1.006","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215639","14.3163","0.0003","10.7538","0.0003","28.2371","0.0007","90","","90","","90","","4347.23","0.19","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H19 Cd N5 S3 -","- C19 H19 Cd N5 S3 -","- C152 H152 Cd8 N40 S24 -","8","1","","Hao, Fuying; Zhang, Xuanjun; Tian, Yupeng; Zhou, Hongping; Li, Lin; Wu, Jieying; Zhang, Shengyi; Yang, Jiaxiang; Jin, Baokang; Tao, Xutang; Zhou, Guangyong; Jiang, Minhua","Design, crystal structures and enhanced frequency-upconverted lasing efficiencies of a new series of dyes from hybrid of inorganic polymers and organic chromophores","Journal of Materials Chemistry","2009","19","48","9163","","10.1039/b914656c","","","0.71073","MoKα","","0.0785","0.0466","","","0.0992","0.119","","","","","","0.937","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215640","12.906","0.002","10.8887","0.0016","19.289","0.004","90","","95.61","0.014","90","","2697.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 Cd N6 S3 -","- C23 H26 Cd N6 S3 -","- C92 H104 Cd4 N24 S12 -","4","1","","Hao, Fuying; Zhang, Xuanjun; Tian, Yupeng; Zhou, Hongping; Li, Lin; Wu, Jieying; Zhang, Shengyi; Yang, Jiaxiang; Jin, Baokang; Tao, Xutang; Zhou, Guangyong; Jiang, Minhua","Design, crystal structures and enhanced frequency-upconverted lasing efficiencies of a new series of dyes from hybrid of inorganic polymers and organic chromophores","Journal of Materials Chemistry","2009","19","48","9163","","10.1039/b914656c","","","0.71073","MoKα","","0.0632","0.0396","","","0.1015","0.1116","","","","","","1.034","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215641","12.7935","0.0016","10.7453","0.0015","20.771","0.003","90","","99.639","0.011","90","","2815.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H31 Cd N5 S3 -","- C25 H31 Cd N5 S3 -","- C100 H124 Cd4 N20 S12 -","4","1","","Hao, Fuying; Zhang, Xuanjun; Tian, Yupeng; Zhou, Hongping; Li, Lin; Wu, Jieying; Zhang, Shengyi; Yang, Jiaxiang; Jin, Baokang; Tao, Xutang; Zhou, Guangyong; Jiang, Minhua","Design, crystal structures and enhanced frequency-upconverted lasing efficiencies of a new series of dyes from hybrid of inorganic polymers and organic chromophores","Journal of Materials Chemistry","2009","19","48","9163","","10.1039/b914656c","","","0.71073","MoKα","","0.073","0.0404","","","0.0841","0.0959","","","","","","1.056","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7215642","14.287","0.003","10.751","0.002","34.037","0.007","90","","90","","90","","5228.1","1.8","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H27 Cd N5 S3 -","- C23 H27 Cd N5 S3 -","- C184 H216 Cd8 N40 S24 -","8","1","","Hao, Fuying; Zhang, Xuanjun; Tian, Yupeng; Zhou, Hongping; Li, Lin; Wu, Jieying; Zhang, Shengyi; Yang, Jiaxiang; Jin, Baokang; Tao, Xutang; Zhou, Guangyong; Jiang, Minhua","Design, crystal structures and enhanced frequency-upconverted lasing efficiencies of a new series of dyes from hybrid of inorganic polymers and organic chromophores","Journal of Materials Chemistry","2009","19","48","9163","","10.1039/b914656c","","","0.71073","MoKα","","0.0693","0.0413","","","0.1036","0.124","","","","","","1.09","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215643","23.862","0.005","12.213","0.003","10.898","0.002","90","","96.596","0.005","90","","3154.9","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C40 H32 N4 Si -","- C40 H32 N4 Si -","- C160 H128 N16 Si4 -","4","0.5","","Son, Ho-Jin; Han, Won-Sik; Wee, Kyung Ryang; Lee, Su-Hyun; Hwang, Ah-Reum; Kwon, Soonnam; Cho, Dae Won; Suh, Il-Hwan; Kang, Sang Ook","Intermolecular peripheral 2,5-bipyridyl interactions by cyclization of 1,1′-silanylene unit of 2,3,4,5-aryl substituted siloles: enhanced thermal stability, high charge carrier mobility, and their application to electron transporting layers for OLEDs","Journal of Materials Chemistry","2009","19","47","8964","","10.1039/b915214h","","","0.71073","MoKα","","0.1107","0.0495","","","0.1217","0.1536","","","","","","1.003","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215644","24.1053","0.0018","12.0672","0.0009","11.233","0.0008","90","","99.075","0.001","90","","3226.6","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C41 H34 N4 Si -","- C41 H34 N4 Si -","- C164 H136 N16 Si4 -","4","0.5","","Son, Ho-Jin; Han, Won-Sik; Wee, Kyung Ryang; Lee, Su-Hyun; Hwang, Ah-Reum; Kwon, Soonnam; Cho, Dae Won; Suh, Il-Hwan; Kang, Sang Ook","Intermolecular peripheral 2,5-bipyridyl interactions by cyclization of 1,1′-silanylene unit of 2,3,4,5-aryl substituted siloles: enhanced thermal stability, high charge carrier mobility, and their application to electron transporting layers for OLEDs","Journal of Materials Chemistry","2009","19","47","8964","","10.1039/b915214h","","","0.71073","MoKα","","0.0912","0.0594","","","0.1695","0.209","","","","","","0.968","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215645","22.863","0.004","10.3528","0.0018","26.024","0.004","90","","90.721","0.004","90","","6159.3","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H30 N4 Si -","- C38 H30 N4 Si -","- C304 H240 N32 Si8 -","8","2","","Son, Ho-Jin; Han, Won-Sik; Wee, Kyung Ryang; Lee, Su-Hyun; Hwang, Ah-Reum; Kwon, Soonnam; Cho, Dae Won; Suh, Il-Hwan; Kang, Sang Ook","Intermolecular peripheral 2,5-bipyridyl interactions by cyclization of 1,1′-silanylene unit of 2,3,4,5-aryl substituted siloles: enhanced thermal stability, high charge carrier mobility, and their application to electron transporting layers for OLEDs","Journal of Materials Chemistry","2009","19","47","8964","","10.1039/b915214h","","","0.71073","MoKα","","0.1863","0.0567","","","0.1318","0.2004","","","","","","0.996","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7216609","21.2208","0.0004","21.2265","0.0004","42.2475","0.0006","90","","90","","90","","19030.1","0.6","198","2","198","2","","","","","","","","4","I b c a","-I 2b 2c","73","","","","- C64 H90 Mn12 O49 -","- C64 H88 Mn12 O49 -","- C512 H704 Mn96 O392 -","8","0.5","","Ruiz-Molina, Daniel; Gerbier, Philippe; Rumberger, Evan; Amabilino, David B.; Guzei, Ilia A.; Folting, Kirsten; Huffman, John C.; Rheingold, Arnold; Christou, George; Veciana, Jaume; Hendrickson, David N.","Characterisation of nanoscopic [Mn12O12(O2CR)16(H2O)4] single-molecule magnets: physicochemical properties and LDI- and MALDI-TOF mass spectrometryLDI- and MALDI-TOF are acronyms for Laser Desorption/Ionisation and Matrix Assisted Laser Desorption/Ionisation Time-of-Flight.","Journal of Materials Chemistry","2002","12","4","1152","","10.1039/b104607c","","","0.71073","MoKα","","0.1126","0.0777","","","0.2138","0.2432","","","","","","1.631","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216610","12.455","0.003","13.057","0.003","16.84","0.003","100.13","0.03","102.79","0.03","100.41","0.03","2559.3","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H35 Mo12 N6 O53 P -","- C12 H27 Mo12 N6 O53 P -","- C24 H54 Mo24 N12 O106 P2 -","2","1","","Han, Zhengbo; Wang, Enbo; Luan, Guoyou; Li, Yangguang; Zhang, Hong; Duan, Yingbo; Hu, Changwen; Hu, Ninghai","Synthesis, properties and structural characterization of an intermolecular photosensitive complex: (HGly-Gly)3PMo12O40·4H2O","Journal of Materials Chemistry","2002","12","4","1169","","10.1039/b107225k","","","0.71073","MoKα","","0.0445","0.0347","","0.0982","0.0955","","","","1.079","1.176","1.176","","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216611","6.91","0.002","11.91","0.003","19.481","0.005","90","","90","","90","","1603.2","0.7","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H21 N2 O5 -","- C16 H21 N2 O5 -","- C64 H84 N8 O20 -","4","1","","Minguet, Maria; Amabilino, David B.; Vidal-Gancedo, José; Wurst, Klaus; Veciana, Jaume","Racemic and enantiomerically pure phenyl α-nitronyl nitroxide radicals: influence of chirality on solution and solid state propertiesElectronic supplementary information (ESI) available: figures showing alternative views of the crystal structures and the shortest distances between SOMOs in the crystals. See http://www.rsc.org/suppdata/jm/b1/b106239p/","Journal of Materials Chemistry","2002","12","3","570","","10.1039/b106239p","","","0.71073","MoKα","","0.0413","0.0322","","0.0776","0.0728","","","","1.055","1.085","1.085","","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216612","8.5129","0.0005","9.4113","0.0007","10.482","0.0008","85.847","0.003","76.415","0.004","79.503","0.004","802.25","0.1","218","2","218","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H21 N2 O5 -","- C16 H21 N2 O5 -","- C32 H42 N4 O10 -","2","1","","Minguet, Maria; Amabilino, David B.; Vidal-Gancedo, José; Wurst, Klaus; Veciana, Jaume","Racemic and enantiomerically pure phenyl α-nitronyl nitroxide radicals: influence of chirality on solution and solid state propertiesElectronic supplementary information (ESI) available: figures showing alternative views of the crystal structures and the shortest distances between SOMOs in the crystals. See http://www.rsc.org/suppdata/jm/b1/b106239p/","Journal of Materials Chemistry","2002","12","3","570","","10.1039/b106239p","","","0.71073","MoKα","","0.0542","0.043","","0.1111","0.1037","","","","1.041","1.082","1.082","","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216613","8.307","0.003","10.366","0.003","20.439","0.004","90","","97.11","0.02","90","","1746.5","0.9","218","2","218","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 N2 O5 -","- C17 H23 N2 O5 -","- C68 H92 N8 O20 -","4","1","","Minguet, Maria; Amabilino, David B.; Vidal-Gancedo, José; Wurst, Klaus; Veciana, Jaume","Racemic and enantiomerically pure phenyl α-nitronyl nitroxide radicals: influence of chirality on solution and solid state propertiesElectronic supplementary information (ESI) available: figures showing alternative views of the crystal structures and the shortest distances between SOMOs in the crystals. See http://www.rsc.org/suppdata/jm/b1/b106239p/","Journal of Materials Chemistry","2002","12","3","570","","10.1039/b106239p","","","0.71073","MoKα","","0.0572","0.0445","","0.1194","0.1098","","","","1.047","1.088","1.088","","","","","has coordinates","180497","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","180502","2020-10-21","18:00:00",""
"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","295835","2024-11-08","15:48:26",""
"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",""
"7217114","9.175","0.002","9.849","0.003","22.197","0.004","90","","94.13","0.02","90","","2000.6","0.8","123","","123","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C16 H31 F6 N2 P -","- C16 H31 F6 N2 P -","- C64 H124 F24 N8 P4 -","4","1","","Gordon, Charles M.; Holbrey, John D.; Kennedy, Alan R.; Seddon, Kenneth R.","Ionic liquid crystals: hexafluorophosphate salts","Journal of Materials Chemistry","1998","8","12","2627","","10.1039/a806169f","","","0.71069","MoKalpha","","0.1082","0.0394","","0.0519","0.0435","","","","","1.339","1.339","","","","","has coordinates","176453","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",""
"7221038","5.771","","5.7801","","8.164","","90","","90.2","","90","","272.325","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sr2 Ho Ru O6","","- Ho O6 Ru Sr2 -","- Ho O6 Ru Sr2 -","- Ho2 O12 Ru2 Sr4 -","2","0.5","","Doi, Y.; Hinatsu, Y.; Shimojo, Y.; Oikawa, K.; Morii, Y.","Magnetic and neutron diffraction study on the ordered perovskite Sr2 Ho Ru O6","Journal of Materials Chemistry","2000","10","","797","800","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"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",""
"7221041","6.807","","11.714","","12.665","","90","","101.6","","90","","989.245","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cs (Nb6 Cl10 O2) Cl2","","- Cl12 Cs Nb6 O2 -","- Cl12 Cs0.992 Nb6 O2 -","- Cl24 Cs1.984 Nb12 O4 -","2","0.5","","Gulo, F.; Perrin, C.","The crystal structure of Cs Nb6 Cl12 O2, a novel niobium cluster oxychloride with interconnected Nb6 Cl14 O4 units","Journal of Materials Chemistry","2000","10","","1721","1724","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221043","3.8495","","3.8495","","15.3927","","90","","90","","90","","228.099","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs La2 (Ti2 Nb O10)","","- Cs La2 Nb O10 Ti2 -","- Cs La2 Nb O10 Ti2 -","- Cs La2 Nb O10 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and CsCa La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221044","3.869","","3.869","","15.235","","90","","90","","90","","228.055","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Cs (Ca La) (Ti Nb2 O10)","","- Ca Cs La Nb2 O10 Ti -","- Ca Cs La Nb2 O10 Ti -","- Ca Cs La Nb2 O10 Ti -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221045","3.8376","","3.8376","","15.3015","","90","","90","","90","","225.348","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs Pr2 (Ti2 Nb O10)","","- Cs Nb O10 Pr2 Ti2 -","- Cs Nb O10 Pr2 Ti2 -","- Cs Nb O10 Pr2 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221046","3.8319","","3.8319","","15.2764","","90","","90","","90","","224.31","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs Nd2 (Ti2 Nb O10)","","- Cs Nb Nd2 O10 Ti2 -","- Cs Nb Nd2 O10 Ti2 -","- Cs Nb Nd2 O10 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221047","3.8195","","3.8195","","15.2371","","90","","90","","90","","222.288","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cs Sm2 (Ti2 Nb O10)","","- Cs Nb O10 Sm2 Ti2 -","- Cs Nb O10 Sm2 Ti2 -","- Cs Nb O10 Sm2 Ti2 -","1","0.0625","","Hong, Y.-S.; Kim, S.-J.; Choy, J.-H.","B-site cation arrangement and crystal structure of layered perovskite compounds Cs Ln2 Ti2 Nb O10 (Ln = La, Pr, Nd, Sm) and Cs Ca La Ti Nb2 O10","Journal of Materials Chemistry","2000","10","","1209","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"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",""
"7221067","15.875","","15.875","","20.752","","90","","90","","120","","4529.16","","","","","","","","","","","","","2","R 3 :H","R 3","146","","H3 (P Mo12 O40)","","- Mo12 P -","- Mo12 P -","- Mo72 P6 -","6","0.666667","","Marosi, L.; Escalona Platero, E.; Cifre, J.; Otero Arean, C.","Thermal dehydration of H3+x P Vx M12-x O40 . y(H2 O) Keggin type heteropolyacids; formation, thermal stability and structure of the anhydrous acids H3 P M12 O40, of the corresponding anhydrides P M12 O38.5 and of a novel trihydrate H3 P W12 O40","Journal of Materials Chemistry","2000","10","","1949","1955","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221068","11.75","","11.75","","11.75","","90","","90","","90","","1622.23","","","","","","","","","","","","","4","P n -3 m :2","-P 4bc 2bc 3","224","","H3 (P W12 O40) (H2 O)3","","- H9 O43 P W12 -","- O43 P W12 -","- O86 P2 W24 -","2","0.0416667","","Marosi, L.; Otero Arean, C.; Escalona Platero, E.; Cifre, J.","Thermal dehydration of H3+x P Vx M12-x O40 . y(H2 O) Keggin type heteropolyacids; formation, thermal stability and structure of the anhydrous acids H3 P M12 O40, of the corresponding anhydrides P M12 O38.5 and of a novel trihydrate H3 P W12 O40","Journal of Materials Chemistry","2000","10","","1949","1955","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221069","16.5779","","9.8223","","13.8562","","90","","90","","90","","2256.25","","","","","","","","","","","","","7","P n a 21","P 2c -2n","33","","(Ga16 P16 O60 (O H)2 F6 O4) (H2 ((C H3)2 N) (C H2)3 (N (C H3)2))4","","- C28 H82 F6 Ga16 N8 O66 P16 -","- C28 F6 Ga16 N8 O66 P16 -","- C28 F6 Ga16 N8 O66 P16 -","1","0.25","","Matijasic, A.; Patarin, J.; Paillaud, J.L.","Synthesis, characterisation and structure determination of Mu-15: anew fluorogallophosphate with fluoride as a specific template of the D4R units","Journal of Materials Chemistry","2000","10","","1345","1351","","","","","","","","","","","","","","","","","","","","","","has coordinates","141047","2020-10-21","18:00:00",""
"7221070","8.608","","12.215","","8.929","","90","","90","","90.76","","938.772","","","","","","","","","","","","","4","P 1 1 21/n","-P 2n","14","","Li3 Fe2 (As O4)3","","- As3 Fe2 Li3 O12 -","- As3 Fe2 Li3 O12 -","- As12 Fe8 Li12 O48 -","4","1","","Mesa, J.L.; Moreno, N.O.; Goni, A.; Brandl, A.L.; Barberis, G.E.; Rojo, T.","Structure and magnetic properties of Li3 Fe2 (As O4)3-x (P O4)x (x=0, 1, 1.5, 2): two sublattice weak ferromagnets","Journal of Materials Chemistry","2000","10","","2779","2785","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221071","15.777","","4.1669","","17.358","","90","","99.249","","90","","1126.3","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","K0.66 Sn4.82 Bi11.18 Se22","","- Bi11.18 K0.66 Se22 Sn4.82 -","- Bi11.18 K0.66 Se22 Sn4.82 -","- Bi11.18 K0.66 Se22 Sn4.82 -","1","0.25","","Mrotzek, A.; Chung, D.-Y.; Hogan, T.; Kanatzidis, M.G.","Structure and thermoelectric properties of the new quaternary tin selenide K1-x Sn5-x Bi11+x Se22","Journal of Materials Chemistry","2000","10","","1667","1672","","","","","","","","","","","","","","","","","","","","","","has coordinates","141087","2020-10-21","18:00:00",""
"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",""
"7221080","8.1379","","8.1379","","8.1379","","90","","90","","90","","538.936","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Li2 Co Mn3 O8","","- Co Li2 Mn3 O8 -","- Co Li2 Mn3 O8 -","- Co4 Li8 Mn12 O32 -","4","0.0208333","","Strobel, P.; Ibarra Palos, A.; Anne, M.; le Cras, F.","Structural, magnetic and lithium insertion properties of spinel-type Li2 Mn3 M O8 oxides (M= Mg, Co, Ni, Cu)","Journal of Materials Chemistry","2000","10","","429","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221081","8.1888","","8.1888","","8.1888","","90","","90","","90","","549.112","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Li2 Cu Mn3 O8","","- Cu Li2 Mn3 O8 -","- Cu Li2 Mn3 O8 -","- Cu4 Li8 Mn12 O32 -","4","0.0208333","","Strobel, P.; Ibarra Palos, A.; Anne, M.; le Cras, F.","Structural, magnetic and lithium insertion properties of spinel-type Li2 Mn3 M O8 oxides (M = Mg, Co, Ni, Cu)","Journal of Materials Chemistry","2000","10","","429","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221082","3.925","","3.925","","19.089","","90","","90","","90","","294.078","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Li2 La (Ta2 O7)","","- La Li2 O7 Ta2 -","- La Li2 O7 Ta2 -","- La2 Li4 O14 Ta4 -","2","0.0625","","Toda, K.; Teranishi, T.; Takahashi, M.; Ye, Z.-G.; Sato, M.; Hinatsu, Y.","Synthesis and structure determination of reduced tantalates, Li2 La Ta2 O7, Li2 Ca2 Ta3 O10 and Na2 Ca2 Ta3 O10, with a layered perovskite structure","Journal of Materials Chemistry","1998","9","","799","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221083","3.8927","","3.8927","","26.591","","90","","90","","90","","402.936","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Li2 Ca2 (Ta3 O10)","","- Ca2 Li2 O10 Ta3 -","- Ca2 Li2 O10 Ta3 -","- Ca4 Li4 O20 Ta6 -","2","0.0625","","Toda, K.; Takahashi, M.; Teranishi, T.; Hinatsu, Y.; Sato, M.; Ye, Z.-G.","Synthesis and structure determination of reduced tantalates, Li2 LaTa2 O7, Li2 Ca2 Ta3 O10 and Na2 Ca2 Ta3 O10, with a layered perovskite structure","Journal of Materials Chemistry","1998","9","","799","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","141142","2020-10-21","18:00:00",""
"7221084","3.8607","","3.8607","","29.216","","90","","90","","90","","435.465","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Na Ca2 (Ta3 O10)","","- Ca2 Na O10 Ta3 -","- Ca2 Na O10 Ta3 -","- Ca4 Na2 O20 Ta6 -","2","0.0625","","Toda, K.; Ye, Z.-G.; Takahashi, M.; Teranishi, T.; Sato, M.; Hinatsu, Y.","Synthesis and structure determination of reduced tantalates, Li2 LaTa2 O7, Li2 Ca2 Ta3 O10 and Na2 Ca2 Ta3 O10, with a layered perovskite structure","Journal of Materials Chemistry","1998","9","","799","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221085","3.8872","","3.8872","","28.655","","90","","90","","90","","432.986","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Na2 Ca2 (Ta3 O10)","","- Ca2 Na2 O10 Ta3 -","- Ca2 Na2 O10 Ta3 -","- Ca4 Na4 O20 Ta6 -","2","0.0625","","Toda, K.; Sato, M.; Takahashi, M.; Teranishi, T.; Ye, Z.-G.; Hinatsu, Y.","Synthesis and structure determination of reduced tantalates, Li2 LaTa2 O7, Li2 Ca2 Ta3 O10 and Na2 Ca2 Ta3 O10, with a layered perovskite structure","Journal of Materials Chemistry","1998","9","","799","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","141144","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",""
"7221090","3.94611","","3.9578","","7.62294","","90","","90","","90","","119.054","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Sm Ba Fe2 O5.036","","- Ba Fe2 O5.036 Sm -","- Ba Fe2 O5.036 Sm -","- Ba Fe2 O5.036 Sm -","1","0.125","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE= Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221091","3.95091","","3.95091","","7.64129","","90","","90","","90","","119.278","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Sm Ba Fe2 O5.091","","- Ba Fe2 O5.091 Sm -","- Ba Fe2 O5.091 Sm -","- Ba Fe2 O5.091 Sm -","1","0.0625","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE = Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221092","3.9397","","3.9397","","7.75526","","90","","90","","90","","120.371","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Sm Ba Fe2 O5.498","","- Ba Fe2 O5.498 Sm -","- Ba Fe2 O5.5 Sm -","- Ba Fe2 O5.5 Sm -","1","0.0625","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE = Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221093","3.96204","","3.96204","","7.67731","","90","","90","","90","","120.517","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Nd Ba Fe2 O5.129","","- Ba Fe2 Nd O5.129 -","- Ba Fe2 Nd O5.13 -","- Ba Fe2 Nd O5.13 -","1","0.0625","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE = Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221094","3.94992","","3.94992","","7.77414","","90","","90","","90","","121.291","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Nd Ba Fe2 O5.5","","- Ba Fe2 Nd O5.5 -","- Ba Fe2 Nd O5.5 -","- Ba Fe2 Nd O5.5 -","1","0.0625","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE = Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221095","3.93723","","3.9483","","7.78524","","90","","90","","90","","121.024","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Nd Ba Fe2 O5.69","","- Ba Fe2 Nd O5.69 -","- Ba Fe2 Nd O5.69 -","- Ba Fe2 Nd O5.69 -","1","0.125","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE = Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221096","15.54166","","3.90558","","7.9773","","90","","90","","90","","484.216","","","","","","","","","","","","","4","P m n a","-P 2ac 2","53","","Nd2 Ba2 Fe4 O11","","- Ba2 Fe4 Nd2 O11 -","- Ba2 Fe4 Nd2 O11 -","- Ba4 Fe8 Nd4 O22 -","2","0.25","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE = Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","141179","2020-10-21","18:00:00",""
"7221097","15.47744","","3.89602","","7.96825","","90","","90","","90","","480.489","","","","","","","","","","","","","4","P m n a","-P 2ac 2","53","","Sm2 Ba2 Fe4 O11","","- Ba2 Fe4 O11 Sm2 -","- Ba2 Fe4 O11 Sm2 -","- Ba4 Fe8 O22 Sm4 -","2","0.25","","Karen, P.; Woodward, P.M.","Synthesis and structural investigations of the double perovskites RE Ba Fe2 O5+w (RE = Nd, Sm)","Journal of Materials Chemistry","1998","9","","789","797","","","","","","","","","","","","","","","","","","","","","","has coordinates","141180","2020-10-21","18:00:00",""
"7221098","7.9734","","7.9734","","13.8178","","90","","90","","90","","878.468","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba La2 Mn S5 -","- Ba La2 Mn S5 -","- Ba4 La8 Mn4 S20 -","4","0.125","","Wakeshima, M.; Hinatsu, Y.; Oikawa, K.; Shimojo, Y.; Morii, Y.","Crystal and magnetic structure of the antiferromagnetic manganese sulfide Ba La2 Mn S5 by powder neutron diffraction measurements","Journal of Materials Chemistry","2000","10","","2183","2185","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221099","3.83382","","3.83382","","28.52129","","90","","90","","90","","419.211","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Ru Sr2 (Gd1.3 Ce0.7) Cu2 O9.8","","- Ce0.7 Cu2 Gd1.3 O9.8 Ru Sr2 -","- Ce0.7 Cu2 Gd1.3 O9.8 Ru Sr2 -","- Ce1.4 Cu4 Gd2.6 O19.6 Ru2 Sr4 -","2","0.0625","","Knee, C.S.; Rainford, B.D.; Weller, M.T.","Crystal structure of the ferromagnetic superconductor Ru Sr2 (Gd1.3 Ce0.7) Cu2 O10-d by powder neutron diffraction","Journal of Materials Chemistry","2000","10","","2445","2447","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221100","3.84237","","3.84237","","28.58029","","90","","90","","90","","421.954","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Ru Sr2 (Gd1.3 Ce0.7) Cu2 O9.74","","- Ce0.7 Cu2 Gd1.3 O9.74 Ru Sr2 -","- Ce0.7 Cu2 Gd1.3 O9.74 Ru Sr2 -","- Ce1.4 Cu4 Gd2.6 O19.48 Ru2 Sr4 -","2","0.0625","","Knee, C.S.; Rainford, B.D.; Weller, M.T.","Crystal structure of the ferromagnetic superconductor Ru Sr2 (Gd1.3 Ce0.7) Cu2 O10-d by powder neutron diffraction","Journal of Materials Chemistry","2000","10","","2445","2447","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221101","22.058","","3.6078","","9.3619","","90","","90","","90","","745.028","","","","","","","","","","","","","4","P c m n","-P 2n 2ac","62","","Na1.29 (V3 O8) (H2 O)0.64","","- H1.28 Na1.29 O8.64 V3 -","- Na1.29 O8.64 V3 -","- Na5.16 O34.56 V12 -","4","0.5","","Legagneur, V.; le Gal la Salle, A.; Verbaere, A.; Guyomard, D.; Piffard, Y.","New layered vanadium oxides My H1-y V3 O8 . n(H2 O) (M = Li, Na, K)obtained by oxidation of the precursor H2 V3 O8","Journal of Materials Chemistry","2000","10","","2805","2810","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"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",""
"7221103","6.4655","","11.545","","12.9333","","90","","105.04","","90","","932.326","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Na0.5 K0.5) K (Sn Si3 O9) (H2 O)","","- H2 K1.5 Na0.5 O10 Si3 Sn -","- K1.5 Na0.5 O10 Si3 Sn -","- K6 Na2 O40 Si12 Sn4 -","4","1","","Lin, Z.; Rocha, J.; Pedrosa de Jesus, J.D.; Ferreira, A.","Synthesis and structure of a novel microporous framework stannosilicate","Journal of Materials Chemistry","2000","10","","1353","1356","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221104","11.739","","11.739","","11.739","","90","","90","","90","","1617.68","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","Th Er2 F10 (H2 O)","","- Er2 F10 H2 O Th -","- Er2.001 F10 O Th0.999 -","- Er16.008 F80 O8 Th7.992 -","8","0.0416667","","le Berre, F.; Boucher, E.; Allain, M.; Courbion, G.","Synthesis, stability and zeolitic behaviour of delta-(A Ln3 F10).x(H2 O) and gamma-(Th Ln2 F10).(H2 O) phases (Ln=lanthanide)","Journal of Materials Chemistry","2000","10","","2578","2586","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221271","7.7206","","7.7206","","5.637","","90","","90","","90","","336.008","","","","","","","","","","","","","3","P 42/n m c :2","-P 4ac 2a","137","","(Bi1.85 Zr0.15) O3.075","","- Bi1.85 O3.075 Zr0.15 -","- Bi1.85 O3.075 Zr0.15 -","- Bi7.4 O12.3 Zr0.6 -","4","0.25","","Abrahams, I.; Bush, A.J.; Chan, S.C.M.; Krok, F.; Wrobel, W.","Stabilisation and characterisation of a new betaIII-phase in Zr-doped Bi2 O3","Journal of Materials Chemistry","2001","11","","1715","1721","","","","","","","","","","","","","","","","","","","","","","has coordinates","146552","2020-10-21","18:00:00",""
"7221272","5.6277","","5.6277","","5.6277","","90","","90","","90","","178.235","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Bi1.85 Zr0.15) O3.075","","- Bi1.85 O3.075 Zr0.15 -","- Bi1.85 O3.0712 Zr0.15 -","- Bi3.7 O6.1424 Zr0.3 -","2","0.0104167","","Abrahams, I.; Bush, A.J.; Wrobel, W.; Krok, F.; Chan, S.C.M.","Stabilisation and characterisation of a new betaIII-phase in Zr-doped Bi2 O3","Journal of Materials Chemistry","2001","11","","1715","1721","","","","","","","","","","","","","","","","","","","","","","has coordinates","146553","2020-10-21","18:00:00",""
"7221273","5.31411","","5.31148","","26.9138","","90","","90","","90","","759.663","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ca4 Mn2 Ti O9.926","","- Ca4 Mn2 O9.926 Ti -","- Ca4 Mn2 O9.926 Ti -","- Ca16 Mn8 O39.704 Ti4 -","4","0.5","","Battle, P.D.; Vente, J.F.; Blundell, S.J.; Coldea, A.I.; Spring, L.E.; Cussen, E.J.; Singleton, J.; Rosseinsky, M.J.","Crystal structure and electronic properties of Ca4 Mn2 Ti O9.93, an n=3 Ruddlesden-Popper compound","Journal of Materials Chemistry","2001","11","","160","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221274","5.6944","","8.0548","","5.6826","","90","","90","","90","","260.645","","","","","","","","","","","","","5","I m m a","-I 2b 2","74","","La Ba In Mn O6","","- Ba In La Mn O6 -","- Ba In La Mn O6 -","- Ba2 In2 La2 Mn2 O12 -","2","0.125","","Battle, P.D.; Singleton, J.; Coldea, A.I.; Jordan, N.A.; Rosseinsky, M.J.","Synthesis, structural chemistry and magnetic properties of La1+x A1-x In Mn O6-d: A = Ba, Sr; x = 0, 0.2","Journal of Materials Chemistry","2001","11","","1656","1661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221275","5.6686","","8.0397","","5.686","","90","","90","","90","","259.133","","","","","","","","","","","","","5","I m m a","-I 2b 2","74","","(La1.2 Ba0.8) In Mn O6","","- Ba0.8 In La1.2 Mn O6 -","- Ba0.8 In La1.2 Mn O6 -","- Ba1.6 In2 La2.4 Mn2 O12 -","2","0.125","","Battle, P.D.; Coldea, A.I.; Jordan, N.A.; Singleton, J.; Rosseinsky, M.J.","Synthesis, structural chemistry and magnetic properties of La1+x A1-x In Mn O6-d: A = Ba, Sr; x = 0, 0.2","Journal of Materials Chemistry","2001","11","","1656","1661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221276","5.6387","","7.9664","","5.646","","90","","90","","90","","253.619","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(La1.2 Sr0.8) In Mn O6","","- In La1.2 Mn O6 Sr0.8 -","- In La1.2 Mn O6 Sr0.8 -","- In2 La2.4 Mn2 O12 Sr1.6 -","2","0.25","","Battle, P.D.; Coldea, A.I.; Jordan, N.A.; Rosseinsky, M.J.; Singleton, J.","Synthesis, structural chemistry and magnetic properties of La1+x A1-x In Mn O6-d: A = Ba, Sr; x = 0, 0.2","Journal of Materials Chemistry","2001","11","","1656","1661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221278","3.9858","","3.9858","","21.785","","90","","90","","90","","346.09","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","K2 Sr (Ta2 O7)","","- K2 O7 Sr Ta2 -","- K2 O7 Sr Ta2 -","- K4 O14 Sr2 Ta4 -","2","0.0625","","Crosnier-Lopez, M.P.; le Berre, F.; Fourquet, J.L.","The layered perovskite K2 Sr Ta2 O7: hydration and K(+)/H(+) ion exchange","Journal of Materials Chemistry","2001","11","","1146","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221279","5.8894","","5.8894","","14.6476","","90","","90","","120","","439.986","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba3 Ce Ru2 O9","","- Ba3 Ce O9 Ru2 -","- Ba3 Ce O9 Ru2 -","- Ba6 Ce2 O18 Ru4 -","2","0.0833333","","Doi, Y.; Wakeshima, M.; Tobo, A.; Hinatsu, Y.; Ohoyama, K.; Yamaguchi, Y.","Crystal structures and magnetic properties of the 6H-perovskites Ba3 Ln Ru2 O9 (Ln = Ce, Pr and Tb)","Journal of Materials Chemistry","2001","11","","3135","3140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221280","5.8855","","5.8855","","14.6071","","90","","90","","120","","438.189","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba3 Pr Ru2 O9","","- Ba3 O9 Pr Ru2 -","- Ba3 O9 Pr Ru2 -","- Ba6 O18 Pr2 Ru4 -","2","0.0833333","","Doi, Y.; Wakeshima, M.; Yamaguchi, Y.; Hinatsu, Y.; Tobo, A.; Ohoyama, K.","Crystal structures and magnetic properties of the 6H-perovskites Ba3 Ln Ru2 O9 (Ln= Ce, Pr and Tb)","Journal of Materials Chemistry","2001","11","","3135","3140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221281","3.7571","","3.7571","","8.792","","90","","90","","90","","124.106","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Tl0.93 Sr2 Co O5","","- Co O5 Sr2 Tl0.93 -","- Co O5 Sr2 Tl0.93 -","- Co O5 Sr2 Tl0.93 -","1","0.0625","","Doumerc, J.P.; Elkaim, E.; Coutanceau, M.; Pouchard, M.; Grenier, J.C.; Demourgues, A.","Crystal structure of the thallium strontium cobaltite Tl Sr2 Co O5 and its relationship to the electronic properties","Journal of Materials Chemistry","2001","11","","78","85","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221282","6.8177","","6.8177","","6.8177","","90","","90","","90","","316.894","","","","","","","","","","","","","3","P 41 3 2","P 4bd 2ab 3","213","","Pd2 Mo3 N","","- Mo3 N Pd2 -","- Mo3 N Pd2 -","- Mo12 N4 Pd8 -","4","0.166667","","El-Himri, A.; Sapina, F.; Ibanez, R.; Beltran, A.","Pd2 Mo3 N : a new molybdenum bimetallic interstitial nitride","Journal of Materials Chemistry","2001","11","","2311","2314","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221283","13.6965","","13.6965","","8.4231","","90","","90","","120","","1368.43","","","","","","","","","","","","","5","P 6/m c c","-P 6 2c","192","","Sn0.108 H1.08 Al1.016 P1.016 O4.82","","- Al1.016 H1.08 O4.82 P1.016 Sn0.108 -","- Al1.016 O4.82 P1.016 Sn0.108 -","- Al12.192 O57.84 P12.192 Sn1.296 -","12","0.5","","Flavell, W.R.; Nicholson, D.G.; Stahl, K.; Nilsen, M.H.","X-ray powder diffraction and EXAFS studies on Sn A P O - 5 and Cu: Sn A P O - 5","Journal of Materials Chemistry","2001","11","","620","627","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221284","13.6935","","13.6935","","8.4689","","90","","90","","120","","1375.27","","","","","","","","","","","","","5","P 6/m c c","-P 6 2c","192","","Sn0.128 H1.788 Al0.906 P0.906 O4.774","","- Al0.906 H1.788 O4.774 P0.906 Sn0.128 -","- Al0.906 O4.774 P0.906 Sn0.128 -","- Al10.872 O57.288 P10.872 Sn1.536 -","12","0.5","","Flavell, W.R.; Nicholson, D.G.; Nilsen, M.H.; Stahl, K.","X-ray powder diffraction and EXAFS studies on Sn A P O - 5 and Cu: Sn A P O - 5","Journal of Materials Chemistry","2001","11","","620","627","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221285","13.7579","","13.7579","","8.3604","","90","","90","","120","","1370.45","","","","","","","","","","","","","6","P 6/m c c","-P 6 2c","192","","Sn0.078 Cu0.356 H0.4 Al0.924 P0.924 O4.408","","- Al0.924 Cu0.356 H0.4 O4.408 P0.924 Sn0.078 -","- Al0.924 Cu0.356 O4.408 P0.924 Sn0.078 -","- Al11.088 Cu4.272 O52.896 P11.088 Sn0.936 -","12","0.5","","Flavell, W.R.; Stahl, K.; Nicholson, D.G.; Nilsen, M.H.","X-ray powder diffraction and EXAFS studies on Sn A P O - 5 and Cu: Sn A P O - 5","Journal of Materials Chemistry","2001","11","","620","627","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221286","8.4435","","8.4435","","21.636","","90","","90","","120","","1335.83","","","","","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","(Li0.72 Na0.88) (Ti1.4 Al0.6) (P O4)3","","- Al0.6 Li0.72 Na0.88 O12 P3 Ti1.4 -","- Al0.6 Li0.72 Na0.88 O12 P3 Ti1.4 -","- Al3.6 Li4.32 Na5.28 O72 P18 Ti8.4 -","6","0.166667","","Mouahid, F.E.; Aranda, M.A.G.; Maldonado-Manso, P.; Zahir, M.; Losilla, E.R.; Bruque, S.; Rivera, A.; Santamaria, J.; Leon, C.","Na-Li exchange of Na1+x Ti2-x Alx (P O4)3 (0.6 <= x <= 0.9) NASICON series: a Rietveld and impedance study","Journal of Materials Chemistry","2001","11","","3258","3263","","","","","","","","","","","","","","","","","","","","","","has coordinates","147162","2020-10-21","18:00:00",""
"7221287","8.4203","","8.4203","","21.592","","90","","90","","120","","1325.8","","","","","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","(Li1.09 Na0.71) (Ti1.2 Al0.8) (P O4)3","","- Al0.8 Li1.09 Na0.71 O12 P3 Ti1.2 -","- Al0.8 Li1.091 Na0.71 O12 P3 Ti1.2 -","- Al4.8 Li6.546 Na4.26 O72 P18 Ti7.2 -","6","0.166667","","Mouahid, F.E.; Bruque, S.; Zahir, M.; Maldonado-Manso, P.; Losilla, E.R.; Aranda, M.A.G.; Rivera, A.; Santamaria, J.; Leon, C.","Na-Li exchange of Na1+x Ti2-x Alx (P O4)3 (0.6 <= x <= 0.9) NASICONseries: a Rietveld and impedance study","Journal of Materials Chemistry","2001","11","","3258","3263","","","","","","","","","","","","","","","","","","","","","","has coordinates","147164","2020-10-21","18:00:00",""
"7221288","8.4001","","8.4001","","21.55","","90","","90","","120","","1316.88","","","","","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","(Li1.45 Na0.45) (Ti1.1 Al0.9) (P O4)3","","- Al0.9 Li1.45 Na0.45 O12 P3 Ti1.1 -","- Al0.9 Li1.45 Na0.45 O12 P3 Ti1.1 -","- Al5.4 Li8.7 Na2.7 O72 P18 Ti6.6 -","6","0.166667","","Mouahid, F.E.; Maldonado-Manso, P.; Zahir, M.; Losilla, E.R.; Bruque, S.; Santamaria, J.; Aranda, M.A.G.; Rivera, A.; Leon, C.","Na-Li exchange of Na1+x Ti2-x Alx (P O4)3 (0.6 <= x <= 0.9) NASICONseries: a Rietveld and impedance study","Journal of Materials Chemistry","2001","11","","3258","3263","","","","","","","","","","","","","","","","","","","","","","has coordinates","147166","2020-10-21","18:00:00",""
"7221289","11.953","","11.953","","8.4211","","90","","90","","90","","1203.16","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","Ba3 Cu3 (Sc2.96 In1.04) O12","","- Ba3 Cu3 In1.04 O12 Sc2.96 -","- Ba3 Cu3 In1.04 O12 Sc2.96 -","- Ba12 Cu12 In4.16 O48 Sc11.84 -","4","0.125","","Gregory, D.H.; Weston, D.P.; Mawdsley, P.R.; Daniell, W.; Barker, S.J.","Synthesis, stoichiometry and structure of the quaternary scandium cuprate Ba3 Cu3 Sc4 O12 and of 334-phase solid solution members Ba3Cu3 Sc4-x Inx O12 (0 <= x <= 4)","Journal of Materials Chemistry","2001","11","","806","814","","","","","","","","","","","","","","","","","","","","","","has coordinates","147279","2020-10-21","18:00:00",""
"7221290","11.9969","","11.9969","","8.4473","","90","","90","","90","","1215.78","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","Ba3 Cu3 (Sc2.316 In1.684) O12","","- Ba3 Cu3 In1.684 O12 Sc2.316 -","- Ba3 Cu3 In1.684 O12 Sc2.316 -","- Ba12 Cu12 In6.736 O48 Sc9.264 -","4","0.125","","Gregory, D.H.; Mawdsley, P.R.; Barker, S.J.; Daniell, W.; Weston, D.P.","Synthesis, stoichiometry and structure of the quaternary scandium cuprate Ba3 Cu3 Sc4 O12 and of 334-phase solid solution members Ba3Cu3 Sc4-x Inx O12 (0 <= x <= 4)","Journal of Materials Chemistry","2001","11","","806","814","","","","","","","","","","","","","","","","","","","","","","has coordinates","147281","2020-10-21","18:00:00",""
"7221291","12.0719","","12.0719","","8.4856","","90","","90","","90","","1236.61","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","Ba3 Cu3 (Sc0.804 In3.196) O12","","- Ba3 Cu3 In3.196 O12 Sc0.804 -","- Ba3 Cu3 In3.196 O12 Sc0.804 -","- Ba12 Cu12 In12.784 O48 Sc3.216 -","4","0.125","","Gregory, D.H.; Mawdsley, P.R.; Barker, S.J.; Daniell, W.; Weston, D.P.","Synthesis, stoichiometry and structure of the quaternary scandium cuprate Ba3 Cu3 Sc4 O12 and of 334-phase solid solution members Ba3 Cu3 Sc4-x Inx O12 (0 <= x <= 4)","Journal of Materials Chemistry","2001","11","","806","814","","","","","","","","","","","","","","","","","","","","","","has coordinates","147283","2020-10-21","18:00:00",""
"7221292","12.1283","","12.1283","","8.5106","","90","","90","","90","","1251.87","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba3 Cu3 In4 O12 -","- Ba3 Cu3 In4 O12 -","- Ba12 Cu12 In16 O48 -","4","0.125","","Gregory, D.H.; Mawdsley, P.R.; Barker, S.J.; Daniell, W.; Weston, D.P.","Synthesis, stoichiometry and structure of the quaternary scandium cuprate Ba3 Cu3 Sc4 O12 and of 334-phase solid solution members Ba3Cu3 Sc4-x Inx O12 (0 <= x <= 4)","Journal of Materials Chemistry","2001","11","","806","814","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221293","15.85","","4.9029","","18.039","","90","","114.849","","90","","1272.05","","","","","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","La3 Si6.5 Al1.5 N9.5 O5.5","","- Al1.5 La3 N9.5 O5.5 Si6.5 -","- Al1.5 La3 N9.4999 O5.5001 Si6.5 -","- Al6 La12 N37.9996 O22.0004 Si26 -","4","0.5","","Grins, J.; Shen, Z.; Esmaeilzadeh, S.; Berastegui, P.","The structures of the Ce and La N-phases RE3 Si8-x Alx N11-x O4+x (x = 1.75 for RE = Ce, x = 1.5 for RE = La), determined by single-crystal X-ray and time-of-flight neutron powder diffraction,respectively","Journal of Materials Chemistry","2001","11","","2358","2362","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221294","3.9239","","3.9239","","14.2976","","90","","90","","90","","220.14","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Sr2 Fe O3 Cl","","- Cl Fe O3 Sr2 -","- Cl Fe O3 Sr2 -","- Cl2 Fe2 O6 Sr4 -","2","0.125","","Hector, A.L.; Thomas, M.F.; Hutchings, J.; Weller, M.T.; Needs, R.L.","Structural and Mossbauer study of Sr2 Fe O3 X (X = F, Cl, Br) and the magnetic structure of Sr2 Fe O3 F","Journal of Materials Chemistry","2001","11","","527","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221295","3.9307","","3.9307","","15.1516","","90","","90","","90","","234.098","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Sr2 Fe O3 Br","","- Br Fe O3 Sr2 -","- Br Fe O3 Sr2 -","- Br2 Fe2 O6 Sr4 -","2","0.125","","Hector, A.L.; Hutchings, J.; Weller, M.T.; Thomas, M.F.; Needs, R.L.","Structural and Mossbauer study of Sr2 Fe O3 X (X = F, Cl, Br) and the magnetic structure of Sr2 Fe O3 F","Journal of Materials Chemistry","2001","11","","527","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221296","5.45099","","5.45099","","26.2932","","90","","90","","90","","781.258","","","","","","","","","","","","","4","P -4 2 c","P -4 2c","112","","Sr2 (Fe O3) F","","- F Fe O3 Sr2 -","- F Fe O3 Sr2 -","- F8 Fe8 O24 Sr16 -","8","1","","Hector, A.L.; Hutchings, J.; Needs, R.L.; Thomas, M.F.; Weller, M.T.","Structural and Moessbauer study of Sr2 Fe O3 X (X= F, Cl, Br) and the magnetic structure of Sr2 Fe O3 F","Journal of Materials Chemistry","2001","11","","527","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221297","5.9314","","9.8974","","11.8859","","90","","119.58","","90","","606.825","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ho2 (Si4 N6 C)","","- C Ho2 N6 Si4 -","- C Ho2 N6 Si4 -","- C4 Ho8 N24 Si16 -","4","1","","Hoeppe, H.A.; Kotzyba, G.; Schnick, W.; Poettgen, R.","High-temperature synthesis, crystal structure, optical properties and magnetism of the carbidonitridosilicates Ho2 (Si4 N6 C) and Tb2(Si4 N6 C)","Journal of Materials Chemistry","2001","11","","3300","3306","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221298","10.3073","","10.3073","","10.3073","","90","","90","","90","","1095.05","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Tl0.55 (Tl0.1 Sb0.57) Sb2 O6.28","","- O6.28 Sb2.57 Tl0.65 -","- O6.28 Sb2.57 Tl0.65 -","- O50.24 Sb20.56 Tl5.2 -","8","0.0416667","","Hong, Y.-S.; Kim, K.","New pyrochlore phases in the ternary oxide Tl - Sb - O","Journal of Materials Chemistry","2001","11","","1533","1536","","","","","","","","","","","","","","","","","","","","","","has coordinates","147503","2020-10-21","18:00:00",""
"7221299","10.2957","","10.2957","","10.2957","","90","","90","","90","","1091.36","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Tl0.57 (Tl0.24 Sb0.43) Sb2 O6.29","","- O6.29 Sb2.43 Tl0.81 -","- O6.29 Sb2.4296 Tl0.81 -","- O50.32 Sb19.4368 Tl6.48 -","8","0.0416667","","Hong, Y.-S.; Kim, K.","New pyrochlore phases in the ternary oxide Tl - Sb - O","Journal of Materials Chemistry","2001","11","","1533","1536","","","","","","","","","","","","","","","","","","","","","","has coordinates","147504","2020-10-21","18:00:00",""
"7221300","10.28204","","10.28204","","10.28204","","90","","90","","90","","1087.02","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Tl0.58 (Tl0.49 Sb0.18) Sb2 O6.3","","- O6.3 Sb2.18 Tl1.07 -","- O6.3 Sb2.18 Tl1.07 -","- O50.4 Sb17.44 Tl8.56 -","8","0.0416667","","Hong, Y.-S.; Kim, K.","New pyrochlore phases in the ternary oxide Tl - Sb - O","Journal of Materials Chemistry","2001","11","","1533","1536","","","","","","","","","","","","","","","","","","","","","","has coordinates","147507","2020-10-21","18:00:00",""
"7221301","5.472","","5.472","","13.204","","90","","90","","120","","342.396","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","La (Ni0.95 Mo0.05) O3","","- La Mo0.05 Ni0.95 O3 -","- La Mo0.05 Ni0.95 O3 -","- La6 Mo0.3 Ni5.7 O18 -","6","0.166667","","Rodriguez, E.; Alvarez, I.; Lopez, M.L.; Veiga, M.L.; Martinez, J.L.; Pico, C.","Structural characterization and physical properties of La Ni1-x MoxO3 (0.05 <= x <= 0.20)","Journal of Materials Chemistry","2001","11","","673","677","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221302","5.443","","5.496","","7.769","","90","","90","","90","","232.408","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La (Ni0.9 Mo0.1) O3","","- La Mo0.1 Ni0.9 O3 -","- La Mo0.1 Ni0.9 O3 -","- La4 Mo0.4 Ni3.6 O12 -","4","0.5","","Rodriguez, E.; Alvarez, I.; Martinez, J.L.; Lopez, M.L.; Veiga, M.L.; Pico, C.","Structural characterization and physical properties of La Ni1-x MoxO3 (0.05 <= x <= 0.20)","Journal of Materials Chemistry","2001","11","","673","677","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221303","5.519","","5.528","","7.807","","90","","90","","90","","238.184","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La (Ni0.85 Mo0.15) O3","","- La Mo0.15 Ni0.85 O3 -","- La Mo0.15 Ni0.85 O3 -","- La4 Mo0.6 Ni3.4 O12 -","4","0.5","","Rodriguez, E.; Alvarez, I.; Lopez, M.L.; Veiga, M.L.; Martinez, J.L.; Pico, C.","Structural characterization and physical properties of La Ni1-x MoxO3 (0.05 <= x <= 0.20)","Journal of Materials Chemistry","2001","11","","673","677","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221304","5.5534","","5.5645","","7.8482","","90","","90","","90","","242.524","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La (Ni0.8 Mo0.2) O3","","- La Mo0.2 Ni0.8 O3 -","- La Mo0.2 Ni0.8 O3 -","- La4 Mo0.8 Ni3.2 O12 -","4","0.5","","Rodriguez, E.; Alvarez, I.; Veiga, M.L.; Lopez, M.L.; Pico, C.; Martinez, J.L.","Structural characterization and physical properties of La Ni1-x Mox O3 (0.05 <= x <= 0.20)","Journal of Materials Chemistry","2001","11","","673","677","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221306","5.4554","","5.4588","","7.7049","","90","","90","","90","","229.451","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.85 Na0.15) (Mn O3)","","- Mn Na0.15 O3 Pr0.85 -","- Mn Na0.15 O3 Pr0.85 -","- Mn4 Na0.6 O12 Pr3.4 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Srinivasa, T.; Vasanthacharya, N.Y.; Subbanna, G.N.; Lalla, N.P.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221307","5.4563","","5.5031","","7.706","","90","","90","","90","","231.385","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.9 Na0.1) (Mn O3)","","- Mn Na0.1 O3 Pr0.9 -","- Mn Na0.1 O3 Pr0.9 -","- Mn4 Na0.4 O12 Pr3.6 -","4","0.5","","Shivakumara, C.; Srinivasa, T.; Hegde, M.S.; Lalla, N.P.; Subbanna, G.N.; Vasanthacharya, N.Y.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221308","5.4579","","5.5149","","7.7065","","90","","90","","90","","231.964","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.92 Na0.08) (Mn O3)","","- Mn Na0.08 O3 Pr0.92 -","- Mn Na0.08 O3 Pr0.92 -","- Mn4 Na0.32 O12 Pr3.68 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Subbanna, G.N.; Srinivasa, T.; Vasanthacharya, N.Y.; Lalla, N.P.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221309","5.4562","","5.5517","","7.6951","","90","","90","","90","","233.094","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.97 Na0.03) (Mn0.94 O3)","","- Mn0.94 Na0.03 O3 Pr0.97 -","- Mn0.94 Na0.03 O3 Pr0.97 -","- Mn3.76 Na0.12 O12 Pr3.88 -","4","0.5","","Shivakumara, C.; Srinivasa, T.; Hegde, M.S.; Vasanthacharya, N.Y.; Subbanna, G.N.; Lalla, N.P.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221310","5.4769","","5.5101","","7.7275","","90","","90","","90","","233.203","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.92 K0.08) (Mn O3)","","- K0.08 Mn O3 Pr0.92 -","- K0.08 Mn O3 Pr0.92 -","- K0.32 Mn4 O12 Pr3.68 -","4","0.5","","Shivakumara, C.; Vasanthacharya, N.Y.; Srinivasa, T.; Hegde, M.S.; Lalla, N.P.; Subbanna, G.N.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221311","5.4625","","5.554","","7.7025","","90","","90","","90","","233.684","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.94 K0.06) (Mn O3)","","- K0.06 Mn O3 Pr0.94 -","- K0.06 Mn O3 Pr0.94 -","- K0.24 Mn4 O12 Pr3.76 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Lalla, N.P.; Srinivasa, T.; Subbanna, G.N.; Vasanthacharya, N.Y.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221312","5.4515","","5.6028","","7.6679","","90","","90","","90","","234.206","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Pr0.98 K0.02) (Mn0.94 O3)","","- K0.02 Mn0.94 O3 Pr0.98 -","- K0.02 Mn0.94 O3 Pr0.98 -","- K0.08 Mn3.76 O12 Pr3.92 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Vasanthacharya, N.Y.; Srinivasa, T.; Lalla, N.P.; Subbanna, G.N.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221313","5.4313","","5.5218","","7.6697","","90","","90","","90","","230.019","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Nd0.89 Na0.11) (Mn O3)","","- Mn Na0.11 Nd0.89 O3 -","- Mn Na0.11 Nd0.89 O3 -","- Mn4 Na0.44 Nd3.56 O12 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Srinivasa, T.; Lalla, N.P.; Subbanna, G.N.; Vasanthacharya, N.Y.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221314","5.4143","","5.6367","","7.6263","","90","","90","","90","","232.745","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Nd0.98 Na0.02) (Mn0.91 O3)","","- Mn0.91 Na0.02 Nd0.98 O3 -","- Mn0.91 Na0.02 Nd0.98 O3 -","- Mn3.64 Na0.08 Nd3.92 O12 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Srinivasa, T.; Lalla, N.P.; Subbanna, G.N.; Vasanthacharya, N.Y.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221315","5.4397","","5.6242","","7.6351","","90","","90","","90","","233.588","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Nd0.95 K0.05) (Mn O3)","","- K0.05 Mn Nd0.95 O3 -","- K0.05 Mn Nd0.95 O3 -","- K0.2 Mn4 Nd3.8 O12 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Srinivasa, T.; Vasanthacharya, N.Y.; Subbanna, G.N.; Lalla, N.P.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221316","5.4158","","5.6563","","7.6223","","90","","90","","90","","233.497","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Nd0.98 K0.02) (Mn0.91 O3)","","- K0.02 Mn0.91 Nd0.98 O3 -","- K0.02 Mn0.91 Nd0.98 O3 -","- K0.08 Mn3.64 Nd3.92 O12 -","4","0.5","","Shivakumara, C.; Hegde, M.S.; Lalla, N.P.; Srinivasa, T.; Vasanthacharya, N.Y.; Subbanna, G.N.","Synthesis, structure and magnetic properties of Ln1-x Ax Mn O3 (Ln = Pr, Nd; A = Na, K) from Na Cl or K Cl flux","Journal of Materials Chemistry","2001","11","","2572","2579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221317","5.2549","","5.3677","","7.562","","90","","90","","90","","213.299","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Tl Ni O3","","- Ni O3 Tl -","- Ni O3 Tl -","- Ni4 O12 Tl4 -","4","0.5","","Kim, S.-J.; Demazeau, G.; Alonso, J.A.; Choy, J.-H.","High pressure synthesis and crystal structure of a new Ni(III) perovskite: Tl Ni O3","Journal of Materials Chemistry","2001","11","","487","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221318","4.1721","","4.1721","","16.376","","90","","90","","90","","285.048","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Ba2 Zr O3 F2 (H2 O)0.46","","- Ba2 F2 H0.92 O3.46 Zr -","- Ba2 F2.002 O3.458 Zr -","- Ba4 F4.004 O6.916 Zr2 -","2","0.0625","","Slater, P.R.; Gover, R.K.B.","Synthesis and structure of the new oxide fluoride Ba2 Zr O3 F2 * x(H2 O) (x = 0.5)","Journal of Materials Chemistry","2001","11","","2035","2038","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221320","5.4472","","5.4901","","28.8125","","90","","90","","90","","861.657","","","","","","","","","","","","","4","P 21 c n","P -2n 2a","33","","Bi4 Nb O8 Cl","","- Bi4 Cl Nb O8 -","- Bi4 Cl Nb O8 -","- Bi16 Cl4 Nb4 O32 -","4","1","","Kusainova, A.M.; Stefanovich, S.Yu.; Dolgikh, V.A.; Mosunov, A.V.; Hervoches, C.H.; Lightfoot, P.","Dielectric properties and structure of Bi4 Nb O8 Cl and Bi4 Ta O8 Cl","Journal of Materials Chemistry","2001","11","","1141","1145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221321","5.4589","","5.5044","","28.6998","","90","","90","","90","","862.371","","","","","","","","","","","","","4","P 21 c n","P -2n 2a","33","","Bi4 Ta O8 Cl","","- Bi4 Cl O8 Ta -","- Bi4 Cl O8 Ta -","- Bi16 Cl4 O32 Ta4 -","4","1","","Kusainova, A.M.; Hervoches, C.H.; Stefanovich, S.Yu.; Mosunov, A.V.; Dolgikh, V.A.; Lightfoot, P.","Dielectric properties and structure of Bi4 Nb O8 Cl and Bi4 Ta O8 Cl","Journal of Materials Chemistry","2001","11","","1141","1145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221323","5.5033","","16.234","","5.3717","","90","","90","","90","","479.911","","","","","","","","","","","","","4","I c m m","-I 2 2b","74","","Sr2 (Mn Ga O5)","","- Ga Mn O5 Sr2 -","- Ga Mn O5 Sr2 -","- Ga4 Mn4 O20 Sr8 -","4","0.25","","Wright, A.J.; Palmer, H.M.; Greaves, C.; Anderson, P.A.","Synthesis and structure of Sr2 Mn Ga O5, a new layered manganese oxide","Journal of Materials Chemistry","2001","11","","1324","1326","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221324","3.072","","3.072","","18.73","","90","","90","","120","","153.077","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ti3 Al C2","","- C2 Al Ti3 -","- C2 Al Ti3 -","- C4 Al2 Ti6 -","2","0.0833333","","Zhou, Y.C.; Wang, X.H.; Chen, S.Q.; Sun, Z.M.","Electronic and structural properties of the layered ternary carbide Ti3 Al C2","Journal of Materials Chemistry","2001","11","","2335","2339","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221399","5.377","","5.3437","","7.578","","90","","90","","90","","217.739","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Pr Co O3","","- Co O3 Pr -","- Co O3 Pr -","- Co4 O12 Pr4 -","4","0.5","","Alonso, J.A.; Martinez-Lope, M.J.; Pomjakushin, V.; de la Calle, C.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221400","5.20213","","5.39826","","7.42412","","90","","90","","90","","208.487","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Tb Co O3","","- Co O3 Tb -","- Co O3 Tb -","- Co4 O12 Tb4 -","4","0.5","","Alonso, J.A.; Pomjakushin, V.; de la Calle, C.; Martinez-Lope, M.J.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221401","5.16983","","5.4104","","7.397","","90","","90","","90","","206.9","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Dy Co O3","","- Co Dy O3 -","- Co Dy O3 -","- Co4 Dy4 O12 -","4","0.5","","Alonso, J.A.; Martinez-Lope, M.J.; Pomjakushin, V.; de la Calle, C.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221402","5.1437","","5.4159","","7.3751","","90","","90","","90","","205.454","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Ho Co O3","","- Co Ho O3 -","- Co Ho O3 -","- Co4 Ho4 O12 -","4","0.5","","Alonso, J.A.; Pomjakushin, V.; Martinez-Lope, M.J.; de la Calle, C.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221403","5.1212","","5.4191","","7.3519","","90","","90","","90","","204.032","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Er Co O3","","- Co Er O3 -","- Co Er O3 -","- Co4 Er4 O12 -","4","0.5","","Alonso, J.A.; de la Calle, C.; Martinez-Lope, M.J.; Pomjakushin, V.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221404","5.1049","","5.4135","","7.3282","","90","","90","","90","","202.518","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Tm Co O3","","- Co O3 Tm -","- Co O3 Tm -","- Co4 O12 Tm4 -","4","0.5","","Alonso, J.A.; Pomjakushin, V.; Martinez-Lope, M.J.; de la Calle, C.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221405","5.086","","5.4147","","7.3071","","90","","90","","90","","201.231","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Yb Co O3","","- Co O3 Yb -","- Co O3 Yb -","- Co4 O12 Yb4 -","4","0.5","","Alonso, J.A.; Martinez-Lope, M.J.; de la Calle, C.; Pomjakushin, V.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221406","5.0667","","5.41565","","7.29356","","90","","90","","90","","200.131","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Lu Co O3","","- Co Lu O3 -","- Co Lu O3 -","- Co4 Lu4 O12 -","4","0.5","","Alonso, J.A.; Martinez-Lope, M.J.; de la Calle, C.; Pomjakushin, V.","Preparation and structural study from neutron diffraction data of R Co O3 (R = Pr, Tb, Dy, Ho, Er, Tm, Yb, Lu) perovskites","Journal of Materials Chemistry","2006","16","","1555","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221407","5.55902","","5.55902","","7.885","","90","","90","","90","","243.668","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Sr2 Fe1.47 Te0.53 O6","","- Fe1.47 O6 Sr2 Te0.53 -","- Fe1.47 O6 Sr2 Te0.53 -","- Fe2.94 O12 Sr4 Te1.06 -","2","0.125","","Augsburger, M.S.; Viola, M.C.; Pedregosa, J.C.; Carbonio, R.E.; Alonso, J.A.","Crystal structure and magnetism of the double perovskites Sr3 Fe2 Te O9 and Ba3 Fe2 Te O9: a neutron diffraction study","Journal of Materials Chemistry","2006","16","","4235","4242","","","","","","","","","","","","","","","","","","","","","","has coordinates","150362","2020-10-21","18:00:00",""
"7221408","5.767","","5.767","","14.1998","","90","","90","","120","","408.99","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba3 (Fe1.99 Te1.01) O9","","- Ba3 Fe1.99 O9 Te1.01 -","- Ba3 Fe1.99 O9 Te1.01 -","- Ba6 Fe3.98 O18 Te2.02 -","2","0.0833333","","Augsburger, M.S.; Viola, M.C.; Pedregosa, J.C.; Carbonio, R.E.; Alonso, J.A.","Crystal structure and magnetism of the double perovskites Sr3 Fe2 Te O9 and Ba3 Fe2 Te O9: a neutron diffraction study","Journal of Materials Chemistry","2006","16","","4235","4242","","","","","","","","","","","","","","","","","","","","","","has coordinates","150363","2020-10-21","18:00:00",""
"7221481","5.567712","","5.567712","","22.01526","","90","","90","","120","","591.028","","","","","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","La5 Zn0.5 Ti3.5 O15","","- La5 O15 Ti3.5 Zn0.5 -","- La5 O15 Ti3.5 Zn0.5 -","- La10 O30 Ti7 Zn -","2","0.166667","","Kuang, X.; Allix, M.M.B.; Rosseinsky, M.J.; Niu, H.J.; Claridge, J.B.; Iddles, D.M.; Ibberson, R.M.","Crstal structure, microwave dielectric properties and AC conductivity of B-cation hexagonal perovskites La5 M(x) Ti(4-x) O15 (x = 0.5, 1; M = Zn, Mg, Ga, Al)","Journal of Materials Chemistry","2006","16","","1038","1045","","","","","","","","","","","","","","","","","","","","","","has coordinates","151170","2020-10-21","18:00:00",""
"7221482","5.563013","","5.563013","","21.98238","","90","","90","","120","","589.149","","","","","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","La5 Mg0.5 Ti3.5 O15","","- La5 Mg0.5 O15 Ti3.5 -","- La5 Mg0.5 O15 Ti3.5 -","- La10 Mg O30 Ti7 -","2","0.166667","","Kuang, X.; Allix, M.M.B.; Claridge, J.B.; Ibberson, R.M.; Rosseinsky, M.J.; Niu, H.J.; Iddles, D.M.","Crstal structure, microwave dielectric properties and AC conductivity of B-cation hexagonal perovskites La5 M(x) Ti(4-x) O15 (x = 0.5, 1; M = Zn, Mg, Ga, Al)","Journal of Materials Chemistry","2006","16","","1038","1045","","","","","","","","","","","","","","","","","","","","","","has coordinates","151171","2020-10-21","18:00:00",""
"7221483","5.545747","","5.545747","","21.95905","","90","","90","","120","","584.877","","","","","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","La5 Ga Ti3 O15","","- Ga La5 O15 Ti3 -","- Ga1.006 La5 O15 Ti3 -","- Ga2.012 La10 O30 Ti6 -","2","0.166667","","Kuang, X.; Niu, H.J.; Allix, M.M.B.; Claridge, J.B.; Rosseinsky, M.J.; Iddles, D.M.; Ibberson, R.M.","Crstal structure, microwave dielectric properties and AC conductivity of B-cation hexagonal perovskites La5 M(x) Ti(4-x) O15 (x = 0.5, 1; M = Zn, Mg, Ga, Al)","Journal of Materials Chemistry","2006","16","","1038","1045","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221484","5.519616","","5.519616","","21.97003","","90","","90","","120","","579.668","","","","","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","La5 Al Ti3 O15","","- Al La5 O15 Ti3 -","- Al La5 O15 Ti3 -","- Al2 La10 O30 Ti6 -","2","0.166667","","Kuang, X.; Allix, M.M.B.; Iddles, D.M.; Claridge, J.B.; Niu, H.J.; Rosseinsky, M.J.; Ibberson, R.M.","Crystal structure, microwave dielectric properties and AC conductivity of B-cation hexagonal perovskites La5 M(x) Ti(4-x) O15 (x = 0.5, 1; M = Zn, Mg, Ga, Al)","Journal of Materials Chemistry","2006","16","","1038","1045","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221496","3.85","","3.85","","26.7861","","90","","90","","90","","397.037","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Li1.8 (V O) La2 Ti3 O10","","- La2 O10 Ti3 V -","- La2 O10 Ti3 V -","- La4 O20 Ti6 V2 -","2","0.0625","","Neiner, D.; Sweany, R.L.; Golub, V.; Wiley, J.B.","Structure and properties of mixed valence titanates, (Li(x) V O) La2 Ti3 O10","Journal of Materials Chemistry","2006","16","","186","191","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222155","8.511","","8.511","","20.843","","90","","90","","120","","1307.53","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Li Ti2 (P O4)3","","- Li O12 P3 Ti2 -","- Li O12 P3 Ti2 -","- Li6 O72 P18 Ti12 -","6","0.166667","","Aatiq, A.; Menetrier, M.; Croguennec, L.; Suard, E.; Delmas, C.","On the structure of Li3 Ti2 (P O4)3","Journal of Materials Chemistry","2002","12","","2971","2978","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222156","8.3828","","8.3828","","22.873","","90","","90","","120","","1391.98","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Li3.18 Ti2 (P O4)3","","- Li3.18 O12 P3 Ti2 -","- Li3.18 O12 P3 Ti2 -","- Li19.08 O72 P18 Ti12 -","6","0.333333","","Aatiq, A.; Menetrier, M.; Croguennec, L.; Suard, E.; Delmas, C.","On the structure of Li3 Ti2 (P O4)3","Journal of Materials Chemistry","2002","12","","2971","2978","","","","","","","","","","","","","","","","","","","","","","has coordinates","156360","2020-10-21","18:00:00",""
"7222157","3.77696","","3.77696","","14.1026","","90","","90","","90","","201.18","","","","","","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","La Sr (Mn O4) F","","- F La Mn O4 Sr -","- F La Mn O4 Sr -","- F2 La2 Mn2 O8 Sr2 -","2","0.125","","Aikens, L.D.; Gillie, L.J.; Li, R.-K.; Greaves, C.","Staged fluorine insertion into manganese oxides with Ruddlesden- Popper structures: La Sr Mn O4 F and La1.2 Sr1.8 Mn2 O7 F","Journal of Materials Chemistry","2002","12","","264","267","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222158","3.8103","","3.8103","","21.722","","90","","90","","90","","315.368","","","","","","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","(La1.2 Sr1.8) (Mn2 O7) F","","- F La1.2 Mn2 O7 Sr1.8 -","- F La1.2 Mn2 O7 Sr1.8 -","- F2 La2.4 Mn4 O14 Sr3.6 -","2","0.125","","Aikens, L.D.; Gillie, L.J.; Li, R.-K.; Greaves, C.","Staged fluorine insertion into manganese oxides with Ruddlesden- Popper structures: La Sr Mn O4 F and La1.2 Sr1.8 Mn2 O7 F","Journal of Materials Chemistry","2002","12","","264","267","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222159","3.86042","","3.86042","","15.6834","","90","","90","","90","","233.727","","","","","","","","","","","","","4","I 4 m m","I 4 -2","107","","Bi2 V O5 F","","- Bi2 F O5 V -","- Bi2 F O5 V -","- Bi4 F2 O10 V2 -","2","0.125","","Akopjan, A.V.; Serov, T.V.; Ardashnikova, E.I.; Dolgikh, V.A.; Lightfoot, P.","A new anion conductive bismuth-vanadium oxyfluoride","Journal of Materials Chemistry","2002","12","","1490","1494","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222161","3.5316","","3.5316","","14.555","","90","","90","","120","","157.212","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Cd (C N2)","","- C Cd N2 -","- C Cd N2 -","- C3 Cd3 N6 -","3","0.0833333","","Baldinozzi, G.; Malinowska, B.; Rakib, M.; Durand, G.","Crystal structure and characterisation of cadmium cyanamide","Journal of Materials Chemistry","2002","12","","268","272","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222163","5.9141","","5.9141","","20.831","","90","","90","","90","","728.597","","","","","","","","","","","","","4","P 42/m n m","-P 4n 2n","136","","Ba La2 (In2 O7)","","- Ba In2 La2 O7 -","- Ba In2 La2 O7 -","- Ba4 In8 La8 O28 -","4","0.25","","Caldes, M.; Michel, C.; Rouillon, T.; Raveau, B.; Hervieu, M.","Novel indates Ln2 Ba In2 O7, n=2 members of the Ruddlesden-Popper family (Ln = La, Nd)","Journal of Materials Chemistry","2002","12","","473","476","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222176","8.3009","","8.3009","","22.502","","90","","90","","120","","1342.77","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Li3 Fe2 (P O4)3","","- Fe2 Li3 O12 P3 -","- Fe2 Li3 O12 P3 -","- Fe12 Li18 O72 P18 -","6","0.333333","","Eyob, P.; Thomas, J.O.; Andersson, A.S.","A neutron powder diffraction study of electrochemically lithiated R - (Li3+x Fe2 (P O4)3) for x = 1.8","Journal of Materials Chemistry","2002","12","","2343","2347","","","","","","","","","","","","","","","","","","","","","","has coordinates","156849","2020-10-21","18:00:00",""
"7222177","8.288","","8.288","","22.542","","90","","90","","120","","1340.98","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Li4.8 Fe2 (P O4)3","","- Fe2 Li4.8 O12 P3 -","- Fe2 Li4.8 O12 P3 -","- Fe12 Li28.8 O72 P18 -","6","0.333333","","Eyob, P.; Andersson, A.S.; Thomas, J.O.","A neutron powder diffraction study of electrochemically lithiated R- (Li3+x Fe2 (P O4)3) for x = 1.8","Journal of Materials Chemistry","2002","12","","2343","2347","","","","","","","","","","","","","","","","","","","","","","has coordinates","156851","2020-10-21","18:00:00",""
"7222184","9.1815","","9.1815","","9.1815","","90","","90","","90","","774","","","","","","","","","","","","","3","P 41 3 2","P 4bd 2ab 3","213","","Na4 (Sn3 O8)","","- Na4 O8 Sn3 -","- Na4 O8 Sn3 -","- Na16 O32 Sn12 -","4","0.166667","","Iwasaki, M.; Takizawa, H.; Endo, T.; Uheda, K.","Synthesis and crystal structure of Na4 Sn3 O8","Journal of Materials Chemistry","2002","12","","1068","1070","","","","","","","","","","","","","","","","","","","","","","has coordinates","157108","2020-10-21","18:00:00",""
"7222187","5.494","","5.4618","","22.4111","","90","","90","","90","","672.493","","","","","","","","","","","","","5","P 2 a n","P -2ab 2","30","","Bi5 Pb Ti3 O14 Cl","","- Bi5 Cl O14 Pb Ti3 -","- Bi4.998 Cl O14 Pb1.002 Ti3 -","- Bi9.996 Cl2 O28 Pb2.004 Ti6 -","2","0.5","","Kusainova, A.M.; Stefanovich, S.Yu.; Irvine, J.T.S.; Lightfoot, P.","Structure-property correlations in the new ferroelectric Bi5 Pb Ti3 O14 Cl and related layered oxyhalide intergrowth phases","Journal of Materials Chemistry","2002","12","","3413","3418","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222188","3.89371","","3.89371","","22.6747","","90","","90","","90","","343.771","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Bi5 Pb Ti3 O14 Cl","","- Bi5 Cl O14 Pb Ti3 -","- Bi4.998 Cl O14 Pb1.002 Ti3 -","- Bi4.998 Cl O14 Pb1.002 Ti3 -","1","0.0625","","Kusainova, A.M.; Stefanovich, S.Yu.; Lightfoot, P.; Irvine, J.T.S.","Structure-property correlations in the new ferroelectric Bi5 Pb Ti3 O14 Cl and related layered oxyhalide intergrowth phases","Journal of Materials Chemistry","2002","12","","3413","3418","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222189","10.5324","","10.5324","","10.5324","","90","","90","","90","","1168.37","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Na Sr Nb2 O6.5","","- Na Nb2 O6.5 Sr -","- Na Nb2 O6.5 Sr -","- Na8 Nb16 O52 Sr8 -","8","0.0416667","","Kim, J.-Y.; Chung, I.; Kim, S.-J.; Choy, J.-H.","Transformation of Dion-Jacobson-type layered oxyfluorides into new anion-deficient pyrochlore-type oxides, A Sr Nb2 O6.5 (A = Li and Na)","Journal of Materials Chemistry","2002","12","","1001","1004","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222190","6.3","","10.692","","4.995","","90","","90.47","","90","","336.45","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Li2 (Mg Si O4)","","- Li2 Mg O4 Si -","- Li2 Mg O4 Si -","- Li8 Mg4 O16 Si4 -","4","1","","Jousseaume, C.; Kahn-Harari, A.; Vivien, D.; Derouet, J.; Villain, F.; Ribot, F.","Structural and spectroscopic characterisation of Cr : Li2 Mg Si O4 (gamma0)","Journal of Materials Chemistry","2002","12","","1525","1529","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222191","3.9626","","3.9626","","30.3257","","90","","90","","90","","476.18","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","K2 Sr1.5 Ta3 O10","","- K2 O10 Sr1.5 Ta3 -","- K2 O10 Sr1.5 Ta3 -","- K4 O20 Sr3 Ta6 -","2","0.0625","","le Berre, F.; Laligant, Y.; Crosnier-Lopez, M.P.; Fourquet, J.L.","Synthesis and crystal structure of K2 Sr1.5 Ta3 O10 and K2 Sr1.5 Ta3 O10 * (H2 O): two new layered perovskite compounds","Journal of Materials Chemistry","2002","12","","258","263","","","","","","","","","","","","","","","","","","","","","","has coordinates","157270","2020-10-21","18:00:00",""
"7222192","3.9499","","3.9499","","17.031","","90","","90","","90","","265.713","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","K2 Sr1.5 Ta3 O10 (H2 O)","","- H2 K2 O11 Sr1.5 Ta3 -","- K2 O11 Sr1.5 Ta3 -","- K2 O11 Sr1.5 Ta3 -","1","0.0625","","le Berre, F.; Crosnier-Lopez, M.P.; Laligant, Y.; Fourquet, J.L.","Synthesis and crystal structure of K2 Sr1.5 Ta3 O10 and K2 Sr1.5 Ta3 O10 * (H2 O): two new layered perovskite compounds","Journal of Materials Chemistry","2002","12","","258","263","","","","","","","","","","","","","","","","","","","","","","has coordinates","157271","2020-10-21","18:00:00",""
"7222198","3.7408","","3.7408","","9.0925","","90","","90","","90","","127.237","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Tl0.38 Sr2.62 Co O4.75","","- Co O4.75 Sr2.62 Tl0.38 -","- Co O4.75 Sr2.62 Tl0.38 -","- Co O4.75 Sr2.62 Tl0.38 -","1","0.0625","","Maignan, A.; Pelloquin, D.; Martin, C.; Hervieu, M.; Raveau, B.","A new form of oxygen deficient 1201-cobaltite (Tl0.4 Sr0.5 Co0.1) Sr2 Co O5-d: structure, transport and magnetic properties","Journal of Materials Chemistry","2002","12","","1009","1016","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222199","3.756","","3.756","","9.0217","","90","","90","","90","","127.274","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Tl0.39 Sr2.61 Co O5.1","","- Co O5.1 Sr2.61 Tl0.39 -","- Co O5.1 Sr2.61 Tl0.39 -","- Co O5.1 Sr2.61 Tl0.39 -","1","0.0625","","Maignan, A.; Pelloquin, D.; Martin, C.; Hervieu, M.; Raveau, B.","A new form of oxygen deficient 1201-cobaltite (Tl0.4 Sr0.5 Co0.1) Sr2 Co O5-d: structure, transport and magnetic properties","Journal of Materials Chemistry","2002","12","","1009","1016","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222200","7.4812","","18.1849","","3.741","","90","","90","","90","","508.944","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Tl0.47 Sr2.53 Co O4.8","","- Co O4.8 Sr2.53 Tl0.47 -","- Co O4.8 Sr2.5275 Tl0.4726 -","- Co4 O19.2 Sr10.11 Tl1.8904 -","4","0.5","","Maignan, A.; Pelloquin, D.; Hervieu, M.; Martin, C.; Raveau, B.","A new form of oxygen deficient 1201-cobaltite (Tl0.4 Sr0.5 Co0.1) Sr2 Co O5-d: structure, transport and magnetic properties","Journal of Materials Chemistry","2002","12","","1009","1016","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222201","5.393","","5.456","","29.08","","90","","90","","90","","855.656","","","","","","","","","","","","","5","F m m m","-F 2 2","69","","La Sr3 Ga Co2 O9","","- Co2 Ga La O9 Sr3 -","- Co2.001 Ga0.999 La O9 Sr3 -","- Co8.004 Ga3.996 La4 O36 Sr12 -","4","0.125","","Prado, F.; Manthiram, A.; Gurunathan, K.","Synthesis, crystal chemistry and electrical, oxygen permeation and magnetic properties of La Sr3 Ga Fe2-x Cox O10-d (0 <= x <= 2 and 0 <= d <= 2)","Journal of Materials Chemistry","2002","12","","2390","2395","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222203","7.2076","","10.1135","","7.3775","","90","","90","","90","","537.776","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Ca2 (Os2 O7)","","- Ca2 O7 Os2 -","- Ca2 O7 Os2 -","- Ca8 O28 Os8 -","4","0.25","","Reading, J.; Knee, C.S.; Weller, M.T.","Syntheses, structures and properties of some osmates(IV,V) adopting the pyrochlore and weberite structures","Journal of Materials Chemistry","2002","12","","2376","2382","","","","","","","","","","","","","","","","","","","","","","has coordinates","157720","2020-10-21","18:00:00",""
"7222204","10.35128","","10.35128","","10.35128","","90","","90","","90","","1109.13","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Pb2 Os2 O6.63","","- O6.63 Os2 Pb2 -","- O6.63 Os2 Pb2 -","- O53.04 Os16 Pb16 -","8","0.0416667","","Reading, J.; Knee, C.S.; Weller, M.T.","Syntheses, structures and properties of some osmates(IV, V) adopting the pyrochlore and weberite structures","Journal of Materials Chemistry","2002","12","","2376","2382","","","","","","","","","","","","","","","","","","","","","","has coordinates","157722","2020-10-21","18:00:00",""
"7222205","10.27315","","10.27315","","10.27315","","90","","90","","90","","1084.2","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Tl2 Os2 O6.69","","- O6.69 Os2 Tl2 -","- O6.69 Os2 Tl2 -","- O53.52 Os16 Tl16 -","8","0.0416667","","Reading, J.; Knee, C.S.; Weller, M.T.","Syntheses, structures and properties of some osmates(IV, V) adopting the pyrochlore and weberite structures","Journal of Materials Chemistry","2002","12","","2376","2382","","","","","","","","","","","","","","","","","","","","","","has coordinates","157724","2020-10-21","18:00:00",""
"7222206","10.29218","","10.29218","","10.29218","","90","","90","","90","","1090.24","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Tl2 Os2 O6.77","","- O6.77 Os2 Tl2 -","- O6.77 Os2 Tl2 -","- O54.16 Os16 Tl16 -","8","0.0416667","","Reading, J.; Weller, M.T.; Knee, C.S.","Syntheses, structures and properties of some osmates(IV, V) adopting the pyrochlore and weberite structures","Journal of Materials Chemistry","2002","12","","2376","2382","","","","","","","","","","","","","","","","","","","","","","has coordinates","157726","2020-10-21","18:00:00",""
"7222207","5.5621","","5.5667","","7.8502","","90","","89.86","","90","","243.061","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La2 Co (Ti O6)","","- Co La2 O6 Ti -","- Co La2 O6 Ti -","- Co2 La4 O12 Ti2 -","2","0.5","","Rodriguez, E.; Lopez, M.L.; Campo, J.; Pico, C.; Veiga, M.L.","Crystal and magnetic structure of the perovskites La2 M Ti O6 (M = Co, Ni)","Journal of Materials Chemistry","2002","12","","2798","2802","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222208","5.5545","","5.5512","","7.8341","","90","","90.08","","90","","241.558","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La2 Ni (Ti O6)","","- La2 Ni O6 Ti -","- La2 Ni O6 Ti -","- La4 Ni2 O12 Ti2 -","2","0.5","","Rodriguez, E.; Campo, J.; Lopez, M.L.; Veiga, M.L.; Pico, C.","Crystal and magnetic structure of the perovskites La2 M Ti O6 (M = Co, Ni)","Journal of Materials Chemistry","2002","12","","2798","2802","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222217","5.9205","","5.9202","","8.375","","90","","90.026","","90","","293.548","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ba2 Y (Re O6)","","- Ba2 O6 Re Y -","- Ba2 O6 Re Y -","- Ba4 O12 Re2 Y2 -","2","0.5","","Sasaki, Y.; Doi, Y.; Hinatsu, Y.","Magnetic and calorimetric studies of double perovskites Ba2 Ln Re O6 (Ln = Y, Nd, Sm-Lu)","Journal of Materials Chemistry","2002","12","","2361","2366","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222218","7.9338","","7.9338","","7.9338","","90","","90","","90","","499.394","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Sr (Mn0.5 Nb0.5) O3","","- Mn0.5 Nb0.5 O3 Sr -","- Mn0.5 Nb0.5 O3 Sr -","- Mn4 Nb4 O24 Sr8 -","8","0.0416667","","Tao Shan-Wen; Irvine, J.T.S.","Study on the structural and electrical properties of the double perovskite oxide Sr Mn0.5 Nb0.5 O3-d","Journal of Materials Chemistry","2002","12","","2356","2360","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222219","4.0022","","4.0022","","4.0022","","90","","90","","90","","64.106","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Sr (Mn0.5 Nb0.5) O2.875","","- Mn0.5 Nb0.5 O2.875 Sr -","- Mn0.5 Nb0.5 O2.8749 Sr -","- Mn0.5 Nb0.5 O2.8749 Sr -","1","0.0208333","","Tao Shan-Wen; Irvine, J.T.S.","Study on the structural and electrical properties of the double perovskite oxide Sr Mn0.5 Nb0.5 O3-d","Journal of Materials Chemistry","2002","12","","2356","2360","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222220","7.9177","","7.9177","","13.5571","","90","","90","","90","","849.894","","","","","","","","","","","","","4","I -4","I -4","82","","Ba La2 Co S5","","- Ba Co La2 S5 -","- Ba Co La2 S5 -","- Ba4 Co4 La8 S20 -","4","0.5","","Wakeshima, M.; Hinatsu, Y.; Ishii, Y.; Shimojo, Y.; Morii, Y.","Crystal structures and magnetic properties of cobalt chalcogenides Ba La2 Co (S1-x Sex)5 (0.0 <= x <= 0.4)","Journal of Materials Chemistry","2002","12","","631","634","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222221","7.589","","8.11","","5.056","","90","","103.934","","90","","302.024","","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","Zr (O3 P (C H2) P O3)","","- C H2 O6 P2 Zr -","- C O6 P2 Zr -","- C2 O12 P4 Zr2 -","2","1","","Serre, C.; Ferey, G.","Hydrothermal synthesis, structure determination from powder data of a three-dimensional zirconium diphosphonate with an exceptionally high thermal stability : Zr (O3 P - (C H2) - P O3) or MIL-57","Journal of Materials Chemistry","2002","12","","2367","2369","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222222","7.0186","","7.0186","","6.19","","90","","90","","90","","304.924","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Lu (Cr O4)","","- Cr Lu O4 -","- Cr Lu O4 -","- Cr4 Lu4 O16 -","4","0.125","","Tezuka, K.; Doi, Y.; Hinatsu, Y.","Crystal structures and magnetic properties of zircon-type Lu1-x Yx Cr O4","Journal of Materials Chemistry","2002","12","","1189","1193","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222223","7.0448","","7.0448","","6.2085","","90","","90","","90","","308.123","","","","","","","","","","","","","4","I 41/a m d :1","I 4bw 2bw -1bw","141","","(Lu0.75 Y0.25) (Cr O4)","","- Cr Lu0.75 O4 Y0.25 -","- Cr Lu0.75 O4 Y0.25 -","- Cr4 Lu3 O16 Y -","4","0.125","","Tezuka, K.; Doi, Y.; Hinatsu, Y.","Crystal structures and magnetic properties of zircon-type Lu1-x Yx Cr O4","Journal of Materials Chemistry","2002","12","","1189","1193","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222224","7.0682","","7.0682","","6.2234","","90","","90","","90","","310.918","","","","","","","","","","","","","4","I 41/a m d :1","I 4bw 2bw -1bw","141","","(Lu0.5 Y0.5) (Cr O4)","","- Cr Lu0.5 O4 Y0.5 -","- Cr Lu0.5 O4 Y0.5 -","- Cr4 Lu2 O16 Y2 -","4","0.125","","Tezuka, K.; Doi, Y.; Hinatsu, Y.","Crystal structures and magnetic properties of zircon-type Lu1-x Yx Cr O4","Journal of Materials Chemistry","2002","12","","1189","1193","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222225","7.0948","","7.0948","","6.2414","","90","","90","","90","","314.168","","","","","","","","","","","","","4","I 41/a m d :1","I 4bw 2bw -1bw","141","","(Lu0.25 Y0.75) (Cr O4)","","- Cr Lu0.25 O4 Y0.75 -","- Cr Lu0.25 O4 Y0.75 -","- Cr4 Lu O16 Y3 -","4","0.125","","Tezuka, K.; Doi, Y.; Hinatsu, Y.","Crystal structures and magnetic properties of zircon-type Lu1-x Yx Cr O4","Journal of Materials Chemistry","2002","12","","1189","1193","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222226","3.8017","","3.8017","","15.5358","","90","","90","","90","","224.538","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Sr2 Ti O3 F1.8","","- F1.8 O3 Sr2 Ti -","- F1.8 O3 Sr2 Ti -","- F3.6 O6 Sr4 Ti2 -","2","0.125","","Slater, P.R.; Gover, R.K.B.","Synthesis and structure of the new oxide fluoride Sr2 Ti O3 F2 from the low temperature fluorination of Sr2 Ti O4: an example of a staged fluorine substitution/insertion reaction","Journal of Materials Chemistry","2002","12","","291","294","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222230","5.4888","","16.2256","","5.3545","","90","","90","","90","","476.867","","","","","","","","","","","","","4","I c m m","-I 2 2b","74","","Sr2 (Mn Ga O5)","","- Ga Mn O5 Sr2 -","- Ga1.001 Mn0.999 O5 Sr2 -","- Ga4.004 Mn3.996 O20 Sr8 -","4","0.25","","Wright, A.J.; Anderson, P.A.; Palmer, H.M.; Greaves, C.","Structures and magnetic ordering in the brownmillerite phases, Sr2 Mn Ga O5 and Ca2 Mn Al O5","Journal of Materials Chemistry","2002","12","","978","982","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222231","5.46258","","14.9533","","5.23135","","90","","90","","90","","427.315","","","","","","","","","","","","","4","I b m 2","I 2 -2b","46","","Ca2 (Mn Al O5)","","- Al Ca2 Mn O5 -","- Al Ca2 Mn O5 -","- Al4 Ca8 Mn4 O20 -","4","0.5","","Wright, A.J.; Palmer, H.M.; Anderson, P.A.; Greaves, C.","Structures and magnetic ordering in the brownmillerite phases, Sr2 Mn Ga O5 and Ca2 Mn Al O5","Journal of Materials Chemistry","2002","12","","978","982","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222309","3.82665","","3.82665","","11.5341","","90","","90","","90","","168.897","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Ru Sr2 Ho Cu2 O8","","- Cu2 Ho O8 Ru Sr2 -","- Cu2 Ho O8 Ru Sr2 -","- Cu2 Ho O8 Ru Sr2 -","1","0.0625","","Aguirre, M.H.; Ruiz-Bustos, R.; Alario-Franco, M.A.","Crystal structure and microdomain texture in Ru Sr2 Ho Cu2 O8","Journal of Materials Chemistry","2003","13","","1156","1160","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222310","5.3852","","5.6498","","7.7078","","91.9529","","89.8097","","91.5411","","234.29","","","","","","","","","","","","","3","P -1","-P 1","2","","Bi (Ni O3)","","- Bi Ni O3 -","- Bi Ni O3 -","- Bi4 Ni4 O12 -","4","2","","Ishiwata, S.; Azuma, M.; Takata, M.; Takano, M.; Nishibori, E.; Sakata, M.; Kato, K.","High pressure synthesis, crystal structure and physical properties of a new Ni(II) perovskite Bi Ni O3","Journal of Materials Chemistry","2002","12","","3733","3737","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222311","3.9657","","3.9657","","3.9657","","90","","90","","90","","62.368","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Sr (Fe0.45 Ga0.05 Ta0.5) O3","","- Fe0.45 Ga0.05 O3 Sr Ta0.5 -","- Fe0.45 Ga0.05 O3 Sr Ta0.5 -","- Fe0.45 Ga0.05 O3 Sr Ta0.5 -","1","0.0208333","","Cussen, E.J.; Battle, P.D.","The influence of structural disorder on the magnetic properties of Sr2 Fe1-x Gax Ta O6 (0 <= x <= 1)","Journal of Materials Chemistry","2003","13","","1210","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222312","7.89232","","7.89232","","7.89232","","90","","90","","90","","491.602","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Sr2 (Ga Ta O6)","","- Ga O6 Sr2 Ta -","- Ga O6 Sr2 Ta -","- Ga4 O24 Sr8 Ta4 -","4","0.0208333","","Cussen, E.J.; Battle, P.D.","The influence of structural disorder on the magnetic properties of Sr2 Fe1-x Gax Ta O6 (0 <= x <= 1)","Journal of Materials Chemistry","2003","13","","1210","1214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222314","6.3881","","6.3881","","16.608","","90","","90","","90","","677.736","","","","","","","","","","","","","6","I 41","I 4bw","80","","V2 ((N H3) C2 H4 (N H2)) (H P O4)4 (H2 O)","","- C2 H15 N2 O17 P4 V2 -","- C2 N2 O17 P4 V2 -","- C4 N4 O34 P8 V4 -","2","0.25","","Calin, N.; Serre, C.; Sevov, S.C.","V(III) V(IV) (H P O4)4 * enH * (H2 O): a mixed-valence vanadium phosphate with an open framework","Journal of Materials Chemistry","2003","13","","531","534","","","","","","","","","","","","","","","","","","","","","","has coordinates","158812","2020-10-21","18:00:00",""
"7222336","5.71167","","5.71167","","14.0768","","90","","90","","120","","397.705","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba (Ir0.2 Fe0.8) O2.932","","- Ba Fe0.8 Ir0.2 O2.932 -","- Ba Fe0.8 Ir0.2 O2.932 -","- Ba6 Fe4.8 Ir1.2 O17.592 -","6","0.25","","Jordan, N.A.; Battle, P.D.; Kilcoyne, S.; Sloan, J.; Manuel, P.","Structural chemistry and magnetic properties of 6H and 15R hexagonal perovskites Ba Irx Fe1-x O3-d","Journal of Materials Chemistry","2003","13","","2617","2625","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222337","5.74145","","5.74145","","14.2308","","90","","90","","120","","406.259","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba (Ir0.575 Fe0.425 O3)","","- Ba Fe0.425 Ir0.575 O3 -","- Ba Fe0.425 Ir0.575 O3 -","- Ba6 Fe2.55 Ir3.45 O18 -","6","0.25","","Jordan, N.A.; Battle, P.D.; Manuel, P.; Sloan, J.; Kilcoyne, S.","Structural chemistry and magnetic properties of 6H and 15R hexagonal perovskites Ba Irx Fe1-x O3-d","Journal of Materials Chemistry","2003","13","","2617","2625","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222338","5.73047","","5.73047","","35.5495","","90","","90","","120","","1010.98","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba (Ir0.27 Fe0.73 O2.95)","","- Ba Fe0.73 Ir0.27 O2.95 -","- Ba Fe0.7296 Ir0.2704 O2.9508 -","- Ba15 Fe10.944 Ir4.056 O44.262 -","15","0.416667","","Jordan, N.A.; Battle, P.D.; Sloan, J.; Kilcoyne, S.; Manuel, P.","Structural chemistry and magnetic properties of 6H and 15R hexagonal perovskites Ba Irx Fe1-x O3-d","Journal of Materials Chemistry","2003","13","","2617","2625","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222339","5.69926","","5.69926","","21.2778","","90","","90","","120","","598.542","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba (Ir0.3 Mn0.7 O3)","","- Ba Ir0.3 Mn0.7 O3 -","- Ba Ir0.3 Mn0.7 O3 -","- Ba9 Ir2.7 Mn6.3 O27 -","9","0.25","","Jordan, N.A.; Battle, P.D.","Structural chemistry and magnetic properties of hexagonal perovskites Ba Irx Mn1-x O3 , x = 0.3, 0.4, 0.5","Journal of Materials Chemistry","2003","13","","2220","2226","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222340","5.71037","","5.71037","","21.4005","","90","","90","","120","","604.342","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba (Ir0.4 Mn0.6 O3)","","- Ba Ir0.4 Mn0.6 O3 -","- Ba Ir0.399667 Mn0.600333 O3 -","- Ba9 Ir3.597 Mn5.403 O27 -","9","0.25","","Jordan, N.A.; Battle, P.D.","Structural chemistry and magnetic properties of hexagonal perovskites Ba Irx Mn1-x O3 , x = 0.3, 0.4, 0.5","Journal of Materials Chemistry","2003","13","","2220","2226","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222341","5.72021","","5.72021","","21.5196","","90","","90","","120","","609.802","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba (Ir0.5 Mn0.5 O3)","","- Ba Ir0.5 Mn0.5 O3 -","- Ba Ir0.5 Mn0.5 O3 -","- Ba9 Ir4.5 Mn4.5 O27 -","9","0.25","","Jordan, N.A.; Battle, P.D.","Structural chemistry and magnetic properties of hexagonal perovskites Ba Irx Mn1-x O3 , x = 0.3, 0.4, 0.5","Journal of Materials Chemistry","2003","13","","2220","2226","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222342","5.5662","","7.5446","","5.232","","90","","90","","90","","219.717","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Yb V O3","","- O3 V Yb -","- O3 V Yb -","- O12 V4 Yb4 -","4","0.5","","Munoz, A.; Alonso, J.A.; Casais, M.T.; Martinez-Lope, M.J.; Martinez, J.L.; Fernandez-Diaz, M.T.","Structural and magnetic transition in Yb V O3: a neutron diffraction study","Journal of Materials Chemistry","2003","13","","1234","1240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222388","10.382","","10.382","","10.382","","90","","90","","90","","1119.03","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Pb2 (Fe Re O6.1)","","- Fe O6.1 Pb2 Re -","- Fe O6.1 Pb2 Re -","- Fe8 O48.8 Pb16 Re8 -","8","0.0416667","","Ramesha, K.; Eichhorn, B.; Sebastian, L.; Gopalakrishnan, J.","Pb2 Fe Re O6: new defect pyrochlore oxide with a geometrically frustrated Fe/Re sublattice","Journal of Materials Chemistry","2003","13","","2011","2014","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222391","5.997","","5.997","","9.659","","90","","90","","120","","300.837","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Sr Y (Si4 N7)","","- N7 Si4 Sr Y -","- N7 Si4 Sr Y -","- N14 Si8 Sr2 Y2 -","2","0.166667","","Fang, C.M.; Li, Y.Q.; Hintzen, H.T.; de With, G.","Crystal and electronic structure of the novel nitrides M Y Si4 N7 (M= Sr, Ba) with peculiar N Si4 coordination","Journal of Materials Chemistry","2003","13","","1480","1483","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222392","6.021","","6.021","","9.803","","90","","90","","120","","307.77","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba Y (Si4 N7)","","- Ba N7 Si4 Y -","- Ba N7 Si4 Y -","- Ba2 N14 Si8 Y2 -","2","0.166667","","Fang, C.M.; de With, G.; Li, Y.Q.; Hintzen, H.T.","Crystal and electronic structure of the novel nitrides M Y Si4 N7 (M= Sr, Ba) with peculiar N Si4 coordination","Journal of Materials Chemistry","2003","13","","1480","1483","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222393","3.86107","","3.86107","","12.42856","","90","","90","","90","","185.283","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Sr1.2 Nd0.8) (Mn0.6 Rh0.4) O4","","- Mn0.6 Nd0.8 O4 Rh0.4 Sr1.2 -","- Mn0.6 Nd0.8 O4 Rh0.4 Sr1.2 -","- Mn1.2 Nd1.6 O8 Rh0.8 Sr2.4 -","2","0.0625","","Gallon, D.J.; Battle, P.D.; Rosseinsky, M.J.; Blundell, S.J.; Coldea, A.I.; Steer, C.","Synthesis and characterization of Sr1.2 Nd0.8 Mn0.6 Rh0.4 O4","Journal of Materials Chemistry","2003","13","","1166","1172","","","","","","","","","","","","","","","","","","","","","","has coordinates","159315","2020-10-21","18:00:00",""
"7222394","10.227","","6.0048","","4.6918","","90","","90","","90","","288.129","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Li Fe (P O4)","","- Fe Li O4 P -","- Fe Li O4 P -","- Fe4 Li4 O16 P4 -","4","0.5","","Garcia-Moreno, O.; Gallardo Amores, J.M.; Alvarez-Vega, M.; Sanjuan, M.L.; Garcia-Jaca, J.; Garcia-Alvarado, F.; Amador, U.","Influence of the structure on the electrochemical performance of lithium transition metal phosphates as cathodic materials in rechargeable lithium batteries: a new high-pressure form of Li M P O4 (M = Fe and Ni)","Journal of Materials Chemistry","2001","13","","1570","1576","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222395","5.523","","8.2565","","6.1583","","90","","90","","90","","280.822","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Li Fe (P O4)","","- Fe Li O4 P -","- Fe Li O4 P -","- Fe4 Li4 O16 P4 -","4","0.25","","Garcia-Moreno, O.; Garcia-Alvarado, F.; Alvarez-Vega, M.; Garcia-Jaca, J.; Gallardo Amores, J.M.; Amador, U.; Sanjuan, M.L.","Influence of the structure on the electrochemical performance of lithium transition metal phosphates as cathodic materials in rechargeable lithium batteries: a new high-pressure form of Li M P O4 (M = Fe and Ni)","Journal of Materials Chemistry","2001","13","","1570","1576","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222396","5.358","","8.1272","","6.1241","","90","","90","","90","","266.677","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Li Ni (P O4)","","- Li Ni O4 P -","- Li Ni O4 P -","- Li4 Ni4 O16 P4 -","4","0.25","","Garcia-Moreno, O.; Alvarez-Vega, M.; Amador, U.; Garcia-Alvarado, F.; Garcia-Jaca, J.; Gallardo Amores, J.M.; Sanjuan, M.L.","Influence of the structure on the electrochemical performance of lithium transition metal phosphates as cathodic materials in rechargeable lithium batteries: a new high-pressure form of Li M P O4 (M = Fe and Ni)","Journal of Materials Chemistry","2001","13","","1570","1576","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222412","5.1057","","5.8545","","5.1062","","90","","110.039","","90","","143.391","","","","","","","","","","","","","3","P 1 2/a 1","-P 2ya","13","","Li2.81 Ru0.04 (Ru O4)","","- Li2.81 O4 Ru1.04 -","- Li2.808 O4 Ru1.039 -","- Li5.616 O8 Ru2.078 -","2","0.5","","Alexander, A.; Grey, C.P.; Burley, J.C.; Battle, P.D.; Gallon, D.J.; Kim Sang-Hwan","Structural and magnetic properties of Li3 Ru O4","Journal of Materials Chemistry","2003","13","","2612","2616","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222413","8.2028","","8.2028","","8.2028","","90","","90","","90","","551.933","","","","","","","","","","","","","5","P -4 3 n","P -4n 2 3","218","","Fe8 (Be Si O4)6 S2","","- Be6 Fe8 O24 S2 Si6 -","- Be6 Fe8 O24 S2 Si6 -","- Be6 Fe8 O24 S2 Si6 -","1","0.0416667","","Armstrong, J.A.; Dann, S.E.; Neumann, K.; Marco, J.F.","Synthesis, structure and magnetic behaviour of the danalite family of minerals, Fe8 (Be Si O4)6 X2 (X = S, Se, Te)","Journal of Materials Chemistry","2003","13","","1229","1233","","","","","","","","","","","","","","","","","","","","","","has coordinates","159779","2020-10-21","18:00:00",""
"7222414","8.2838","","8.2838","","8.2838","","90","","90","","90","","568.445","","","","","","","","","","","","","5","P -4 3 n","P -4n 2 3","218","","Fe8 (Be Si O4)6 Se2","","- Be6 Fe8 O24 Se2 Si6 -","- Be6 Fe8 O24 Se2 Si6 -","- Be6 Fe8 O24 Se2 Si6 -","1","0.0416667","","Armstrong, J.A.; Dann, S.E.; Marco, J.F.; Neumann, K.","Synthesis, structure and magnetic behaviour of the danalite family of minerals, Fe8 (Be Si O4)6 X2 (X = S, Se, Te)","Journal of Materials Chemistry","2003","13","","1229","1233","","","","","","","","","","","","","","","","","","","","","","has coordinates","159783","2020-10-21","18:00:00",""
"7222415","8.3685","","8.3685","","8.3685","","90","","90","","90","","586.061","","","","","","","","","","","","","5","P -4 3 n","P -4n 2 3","218","","Fe8 (Be Si O4)6 Te2","","- Be6 Fe8 O24 Si6 Te2 -","- Be6 Fe8 O24 Si6 Te2 -","- Be6 Fe8 O24 Si6 Te2 -","1","0.0416667","","Armstrong, J.A.; Dann, S.E.; Neumann, K.; Marco, J.F.","Synthesis, structure and magnetic behaviour of the danalite family of minerals, Fe8 (Be Si O4)6 X2 (X = S, Se, Te)","Journal of Materials Chemistry","2003","13","","1229","1233","","","","","","","","","","","","","","","","","","","","","","has coordinates","159787","2020-10-21","18:00:00",""
"7222417","10.6755","","10.6755","","38.9339","","90","","90","","120","","3842.69","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Sr9.04 Ni1.02 Na0.88 (P O4)7","","- Na0.88 Ni1.02 O28 P7 Sr9.04 -","- Na0.88 Ni1.02 O28 P7 Sr9.04 -","- Na5.28 Ni6.12 O168 P42 Sr54.24 -","6","0.333333","","Belik, A.A.; Izumi, F.; Ikeda, T.; Malakho, A.P.; Lazoryak, B.I.","Strontium phosphates with beta-(Ca3 (P O4)2)-type structures: Sr9 Ni Li (P O4)7, Sr9.04 Ni1.02 Na0.88 (P O4)7 and Sr9.08 Ni1.04 K0.76 (P O4)7","Journal of Materials Chemistry","2002","12","","3803","3808","","","","","","","","","","","","","","","","","","","","","","has coordinates","159944","2020-10-21","18:00:00",""
"7222418","10.7128","","10.7128","","38.9492","","90","","90","","120","","3871.11","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Sr9.08 Ni1.04 K0.76 (P O4)7","","- K0.76 Ni1.04 O28 P7 Sr9.08 -","- K0.76 Ni1.04 O28 P7 Sr9.08 -","- K4.56 Ni6.24 O168 P42 Sr54.48 -","6","0.333333","","Belik, A.A.; Izumi, F.; Ikeda, T.; Malakho, A.P.; Lazoryak, B.I.","Strontium phosphates with beta-(Ca3 (P O4)2)-type structures: Sr9 Ni Li (P O4)7, Sr9.04 Ni1.02 Na0.88 (P O4)7 and Sr9.08 Ni1.04 K0.76(P O4)7","Journal of Materials Chemistry","2002","12","","3803","3808","","","","","","","","","","","","","","","","","","","","","","has coordinates","159947","2020-10-21","18:00:00",""
"7222424","6.8943","0.0003","11.9131","0.0005","4.80742","0.00005","90","","90","","90.268","0.003","394.84","0.02","90","","90","","","","","","","","","2","?","?","","","","","- Mn5 Si3 -","- Mn10 Si6 -","- Mn20 Si12 -","2","","","Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas","Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material","Journal of Materials Chemistry","2012","22","30","15275","","10.1039/c2jm00154c","powder diffraction","","","neutron","","","","","","","","","","","","","","","","","has coordinates","160195","2020-10-21","18:00:00",""
"7222425","6.8939","0.0003","11.9135","0.0005","4.80731","0.00005","90","","90","","90.262","0.003","394.82","0.02","90","","90","","","","","","","","","2","?","?","","","","","- Mn5 Si3 -","- Mn10 Si6 -","- Mn20 Si12 -","2","","","Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas","Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material","Journal of Materials Chemistry","2012","22","30","15275","","10.1039/c2jm00154c","powder diffraction","","","neutron","","","","","","","","","","","","","","","","","has coordinates","160195","2020-10-21","18:00:00",""
"7222426","6.8929","0.0003","11.9152","0.0005","4.8061","0.00004","90","","90","","90.222","0.003","394.72","0.02","90","","90","","","","","","","","","2","?","?","","","","","- Mn5 Si3 -","- Mn10 Si6 -","- Mn20 Si12 -","2","","","Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas","Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material","Journal of Materials Chemistry","2012","22","30","15275","","10.1039/c2jm00154c","powder diffraction","","","neutron","","","","","","","","","","","","","","","","","has coordinates","160195","2020-10-21","18:00:00",""
"7222428","6.8924","0.0003","11.9164","0.0005","4.80483","0.00004","90","","90","","90.2","0.003","394.63","0.02","90","","90","","","","","","","","","2","?","?","","","","","- Mn5 Si3 -","- Mn10 Si6 -","- Mn20 Si12 -","2","","","Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas","Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material","Journal of Materials Chemistry","2012","22","30","15275","","10.1039/c2jm00154c","powder diffraction","","","neutron","","","","","","","","","","","","","","","","","has coordinates","160195","2020-10-21","18:00:00",""
"7222429","6.90396","0.00006","11.89561","0.00011","4.7959","0.00004","90","","90","","90","","393.872","0.006","90","","90","","","","","","","","","2","C c m m","-C 2c 2c","63","","","","- Mn5 Si3 -","- Mn10 Si6 -","- Mn20 Si12 -","2","0.125","","Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas","Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material","Journal of Materials Chemistry","2012","22","30","15275","","10.1039/c2jm00154c","powder diffraction","","","neutron","","","","","","","","","","","","","","","","","has coordinates","160195","2020-10-21","18:00:00",""
"7222430","6.90198","0.00006","11.90062","0.00011","4.7964","0.00004","90","","90","","90","","393.966","0.006","90","","90","","","","","","","","","2","C c m m","-C 2c 2c","63","","","","- Mn5 Si3 -","- Mn10 Si6 -","- Mn20 Si12 -","2","0.125","","Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas","Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material","Journal of Materials Chemistry","2012","22","30","15275","","10.1039/c2jm00154c","powder diffraction","","","neutron","","","","","","","","","","","","","","","","","has coordinates","160195","2020-10-21","18:00:00",""
"7222431","6.899","0.00007","11.90799","0.00011","4.7973","0.00004","90","","90","","90","","394.114","0.006","90","","90","","","","","","","","","2","C c m m","-C 2c 2c","63","","","","- Mn5 Si3 -","- Mn10 Si6 -","- Mn20 Si12 -","2","0.125","","Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas","Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material","Journal of Materials Chemistry","2012","22","30","15275","","10.1039/c2jm00154c","powder diffraction","","","neutron","","","","","","","","","","","","","","","","","has coordinates","160195","2020-10-21","18:00:00",""
"7222433","5.75961","","5.7787","","8.14843","","90","","90.325","","90","","271.2","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Sr2 Y (Ru0.85 Cu0.15 O6)","","- Cu0.15 O6 Ru0.85 Sr2 Y -","- Cu0.15 O6 Ru0.85 Sr2 Y -","- Cu0.3 O12 Ru1.7 Sr4 Y2 -","2","0.5","","Parkinson, N.G.; Wu Mawkuen; Hatton, P.D.; Howard, J.A.K.; Ritter, C.; Chien Fan, Z.","Crystal and magnetic structures of A2 Y Ru1-x Cux O6 with A = Sr, Ba and x = 0.05 to 0.15","Journal of Materials Chemistry","2003","13","","1468","1474","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222434","8.31696","","8.31696","","8.31696","","90","","90","","90","","575.299","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","Ba2 Y (Ru0.9 Cu0.1 O6)","","- Ba2 Cu0.1 O6 Ru0.9 Y -","- Ba2 Cu0.1 O6 Ru0.9 Y -","- Ba8 Cu0.4 O24 Ru3.6 Y4 -","4","0.0208333","","Parkinson, N.G.; Hatton, P.D.; Howard, J.A.K.; Chien Fan, Z.; Ritter, C.; Wu Mawkuen","Crystal and magnetic structures of A2 Y Ru1-x Cux O6 with A = Sr, Ba and x = 0.05 to 0.15","Journal of Materials Chemistry","2003","13","","1468","1474","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222435","2.88467","","2.88467","","14.25943","","90","","90","","120","","102.76","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.9312 Ni0.0688) (Li0.0688 Ni0.6312 Mn0.3) O2","","- Li Mn0.3 Ni0.7 O2 -","- Li Mn0.3 Ni0.7 O2 -","- Li3 Mn0.9 Ni2.1 O6 -","3","0.0833333","","Kobayashi, H.; Sakaebe, H.; Kageyama, H.; Tatsumi, K.; Arachi, Y.; Kamiyama, T.","Changes in the structure and physical properties of the solid solution Li Ni1-x Mnx O2 with variation in its composition","Journal of Materials Chemistry","2003","13","","590","595","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222436","2.89166","","2.89166","","14.28997","","90","","90","","120","","103.48","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.9034 Ni0.0966) (Li0.0966 Ni0.5034 Mn0.4) O2","","- Li Mn0.4 Ni0.6 O2 -","- Li Mn0.4 Ni0.6 O2 -","- Li3 Mn1.2 Ni1.8 O6 -","3","0.0833333","","Kobayashi, H.; Kageyama, H.; Sakaebe, H.; Tatsumi, K.; Arachi, Y.; Kamiyama, T.","Changes in the structure and physical properties of the solid solution Li Ni1-x Mnx O2 with variation in its composition","Journal of Materials Chemistry","2003","13","","590","595","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222706","6.5463","","6.5463","","6.5463","","90","","90","","90","","280.535","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","Eu Pt Ge","","- Eu Ge Pt -","- Eu Ge Pt -","- Eu4 Ge4 Pt4 -","4","0.333333","","Poettgen, R.; Muellmann, R.; Kremer, R.K.; Mosel, B.D.; Schnelle, W.","Magnetic, electrical and 151Eu Moessbauer properties of Eu Pt Ge","Journal of Materials Chemistry","1996","6","","635","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222942","9.8139","","8.8615","","6.837","","90","","107.67","","90","","566.533","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","(Cr.738 Fe.262) (V O4)","","- Cr0.738 Fe0.262 O4 V -","- Cr0.738 Fe0.262 O4 V -","- Cr5.904 Fe2.096 O32 V8 -","8","1","","Attfield, J.P.; Cheetham, A.K.; Johnson, D.C.; Novet, T.","Magnetic frustration,spirals and short range order in CrxFe1-xVO4-I solid solutions","Journal of Materials Chemistry","1991","1","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222955","4.1231","","12.3641","","7.2071","","90","","90","","90","","367.407","","","","","","","","","","","","","3","P b c m","-P 2c 2b","57","","(U O2) (V O3)","","- O5 U V -","- O5 U V -","- O20 U4 V4 -","4","0.5","","Dickens, P.G.; Stuttard, G.P.; Ball, R.G.J.; Hull, S.; Powell, A.V.; Patat, S.","Powder neutron diffraction study of the mixed uraniumvanadium oxides Cs2(UO2)2(V2O8) and UVO5","Journal of Materials Chemistry","1992","2","","161","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222956","10.521","","8.4369","","7.308","","90","","106.08","","90","","623.312","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Cs2 (U O2)2 (V2 O8)","","- Cs2 O12 U2 V2 -","- Cs2 O12 U2 V2 -","- Cs4 O24 U4 V4 -","2","0.5","","Dickens, P.G.; Stuttard, G.P.; Ball, R.G.J.; Patat, S.; Hull, S.; Powell, A.V.","Powder neutron diffraction study of the mixed uraniumvanadium oxides Cs2(UO2)2(V2O8) and UVO5","Journal of Materials Chemistry","1992","2","","161","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222960","5.495","","5.495","","13.234","","90","","90","","120","","346.065","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La0.8 Sr0.2) Cu O2.64","","- Cu La0.8 O2.64 Sr0.2 -","- Cu La0.8 O2.64 Sr0.2 -","- Cu6 La4.8 O15.84 Sr1.2 -","6","0.166667","","Currie, D.B.; Weller, M.T.","Structure of La0.8 Sr0.2 Cu O2.64 Powder neutron diffraction on very small sample volumes","Journal of Materials Chemistry","1991","1","","295","296","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222994","7.5247","","7.5247","","9.9657","","90","","90","","120","","488.671","","","","","","","","","","","","","4","P 3 1 c","P 3 -2c","159","","Li Ca (P O4)","","- Ca Li O4 P -","- Ca Li O4 P -","- Ca6 Li6 O24 P6 -","6","1","","Lightfoot, P.; Pienkowski, M.C.; Bruce, P.G.; Abrahams, I.","Synthesis and structure of LiCaPO4 by combined x-ray and neutron powder diffraction","Journal of Materials Chemistry","1991","1","","1061","1063","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223685","3.284","","3.284","","7.488","","90","","90","","90","","80.756","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","Fe0.88 Sc C2","","- C2 Fe0.88 Sc -","- C2 Fe0.88 Sc -","- C4 Fe1.76 Sc2 -","2","0.125","","Poettgen, R.; Jeitschko, W.; Wortmann, U.; Danebrock, M.E.","Crystal structures and physical properties of the ternary carbides Sc T1-x C2 (T= Fe, Co, Ni)","Journal of Materials Chemistry","1992","2","","633","637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223698","3.9033","","3.9033","","7.4925","","90","","90","","90","","114.154","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Sr2 Cu O2 (C O3)","","- C Cu O5 Sr2 -","- C Cu O5 Sr2 -","- C Cu O5 Sr2 -","1","0.0625","","Narendra Babu, T.G.; Fish, D.J.; Greaves, C.","Synthesis, structure and electric properties of Sr2CuO2 (CO3), an oxide carbonate related to perovskite","Journal of Materials Chemistry","1991","1","","677","679","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223704","27.1925","","27.1925","","41.0974","","90","","90","","90","","30388.7","","","","","","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","Na15 Mn10 ((H P O4) (P O4)3 Mo6 O12 (O H)3)4 (P O4) (H2 O)48","","- Mn10 Mo24 Na10 O165 P17 -","- Mn10 Mo24 Na10 O165 P17 -","- Mn80 Mo192 Na80 O1320 P136 -","8","0.25","","du Peloux, C.; Mialane, P.; Dolbecq, A.; Marrot, J.; Riviere, E.; Secheresse, F.","Synthesis, crystal structure and magnetic properties of new molybdenum(V) phosphates containing Mn(2+) or Co(2+) with three-dimensional structures directed by the nature of the transition metal","Journal of Materials Chemistry","2001","11","","3392","3396","","","","","","","","","","","","","","","","","","","","","","has coordinates","172966","2020-10-21","18:00:00",""
"7223709","28.1613","","14.2131","","12.998","","90","","114.79","","90","","4723.16","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Na12 Co3 ((P O4)4 Mo6 O12 (O H)3)2 (H2 O)44","","- Co3 Mo12 Na12 O102 P8 -","- Co3 Mo12 Na12 O102 P8 -","- Co6 Mo24 Na24 O204 P16 -","2","0.25","","du Peloux, C.; Mialane, P.; Secheresse, F.; Marrot, J.; Riviere, E.; Dolbecq, A.","Synthesis, crystal structure and magnetic properties of new molybdenum(V) phosphates containing Mn(2+) or Co(2+) with three-dimensional structures directed by the nature of the transition metal","Journal of Materials Chemistry","2001","11","","3392","3396","","","","","","","","","","","","","","","","","","","","","","has coordinates","173087","2020-10-21","18:00:00",""
"7223710","9.7375","","9.9167","","10.3684","","88.083","","64.141","","87.847","","900.163","","","","","","","","","","","","","4","P -1","-P 1","2","","La14 Cu V6 O36.5","","- Cu La14 O36.5 V6 -","- Cu La14 O36.5 V6 -","- Cu La14 O36.5 V6 -","1","0.5","","Gopalakrishnan, J.; Eichhorn, B.W.; Gonen, Z.S.; Fettinger, J.C.; Chang, K.-S.; Mandal, T.K.; Takeuchi, I.; Greene, R.L.","Synthesis and structure of La14 V6 Cu O36.5: a transparent Cu(I) vanadate containing (O Cu O)(3-) sticks","Journal of Materials Chemistry","2002","12","","3839","3842","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223711","10.7451","","9.1941","","13.2112","","90","","103.66","","90","","1268.24","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(N H4) (Zn (H2 O)) (V O)2 (P O4)2 (H2 P O4)","","- H8 N O15 P3 V2 Zn -","- N O15 P3 V2 Zn -","- N4 O60 P12 V8 Zn4 -","4","1","","le Fur, E.; Pena, O.; Pivan, J.Y.","Magnetic susceptibility and crystal structure of the new oxovanadium phosphate (N H4) Zn (H2 O) (V O)2 (P O4)2 (H2 P O4)","Journal of Materials Chemistry","2002","12","","132","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223823","5.341","","15.232","","11.084","","90","","90","","90","","901.729","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bi (Bi0.12 Y0.88) (Ge O5)","","- Bi1.12 Ge O5 Y0.88 -","- Bi1.12 Ge O5 Y0.88 -","- Bi8.96 Ge8 O40 Y7.04 -","8","1","","Cascales, C.; Campa, J.A.; Gutierrez Puebla, E.; Monge, M.A.; Ruiz-Valero, C.; Rasines, I.","New rare-earth (Y, Yb) bismuth(III) germanates. An initial study of a promising series","Journal of Materials Chemistry","2002","12","","3626","3630","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"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",""
"7227041","9.366","0.001","9.882","0.001","19.183","0.002","85.406","0.005","85.029","0.005","114.485","0.005","1596.5","0.3","","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H34 N4 O25 P6 Zn5 -","- C12 N4 O25 P6 Zn5 -","- C24 N8 O50 P12 Zn10 -","2","1","","Harrison, William T. A.; Nenoff, Tina M.; Eddy, Michael, M.; Martin, Theresa E.; Stucky, Galen, D.","Organic templates in zincophosphates synthesis : Zn5(PO4)2(HPO4)4.H2O.2H2N2C6H12, containing two distinct eight-ring channels and Zn3(PO4)(HPO4)2.HN2C6H12, containing tetrahedral three-rings and Zn-N bonds","Journal of Materials Chemistry","1992","2","","1127","1134","10.1039/JM9920201127","","x-ray","0.71073","MoKα","","","0.0711","","","0.0755","","","","","","","","","","","has coordinates","188359","2020-10-21","18:00:00",""
"7227042","11.095","0.002","16.413","0.002","8.263","0.001","90","","90","","90","","1504.7","0.4","","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 N2 O12 P3 Zn3 -","- C6 N2 O12 P3 Zn3 -","- C24 N8 O48 P12 Zn12 -","4","1","","Harrison, William T. A.; Nenoff, Tina M.; Eddy, Michael, M.; Martin, Theresa E.; Stucky, Galen, D.","Organic templates in zincophosphates synthesis : Zn5(PO4)2(HPO4)4.H2O.2H2N2C6H12, containing two distinct eight-ring channels and Zn3(PO4)(HPO4)2.HN2C6H12, containing tetrahedral three-rings and Zn-N bonds","Journal of Materials Chemistry","1992","2","","1127","1134","10.1039/JM9920201127","","x-ray","0.71073","MoKα","","","0.0571","","","0.0589","","","","","","","","","","","has coordinates","189831","2020-10-21","18:00:00",""
"7227610","12.9695","0.0008","10.6898","0.0007","6.4932","0.0004","90","","90","","90","","900.23","0.1","","","293","","","","","","","","","5","P n 21 a","P -2ac -2n","33","","","","- As0.5 K O5 P0.5 Ti -","- As0.5 K O5 P0.5 Ti -","- As4 K8 O40 P4 Ti8 -","8","2","","Crennell, Susan J.; Cheetham, Anthony K; Jarman, Richard H.; Thrash, Robert J.; Kaduk, James A.","Isomorphous substitution in non-linear optical KTiOPO4: neutron powder diffraction study of KTiO(P0.5As0.5)O4","Journal of Materials Chemistry","1992","2","","383","386","10.1039/JM9920200383","powder diffraction","neutron","","ToF","","","","","","","","","","","","","","","","","has coordinates","191182","2020-10-21","18:00:00",""
"7227625","13.2382","0.0004","10.7083","0.0003","6.5581","0.0002","90","","90","","90","","929.67","0.05","","","293","","","","","","","","","5","P n 21 a","P -2ac -2n","33","","","","- K0.5 O5 P Rb0.5 Sn -","- K0.5 O5 P Rb0.5 Sn -","- K4 O40 P8 Rb4 Sn8 -","8","2","","Crennel, Susan J.; Cheetham, Anthony K.; Kaduk, James, A.; Jarman, Richard H.","Isomorphous substitution in non-linear optical KTiOPO4: powder diffraction studies of K0.5Rb0.5SnOPO4, K0.5Na0.5Ti0.5Sn0.5OPO4, Na0.5Rb0.5Ti0.5Sn0.5OPO4 and K0.5Rb0.5Ti0.5Sn0.5OPO4","Journal of Materials Chemistry","1992","2","","785","792","10.1039/JM9920200785","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","0.0666","","","","","","","","","has coordinates","191788","2020-10-21","18:00:00",""
"7227626","12.8826","0.0004","10.6384","0.0004","6.3898","0.0002","90","","90","","90","","875.72","0.05","","","293","","","","","","","","","6","P n 21 a","P -2ac -2n","33","","","","- K0.5 Na0.5 O5 P Sn0.5 Ti0.5 -","- K0.5 Na0.5 O5 P Sn0.5 Ti0.5 -","- K4 Na4 O40 P8 Sn4 Ti4 -","8","2","","Crennel, Susan J.; Cheetham, Anthony K.; Kaduk, James, A.; Jarman, Richard H.","Isomorphous substitution in non-linear optical KTiOPO4: powder diffraction studies of K0.5Rb0.5SnOPO4, K0.5Na0.5Ti0.5Sn0.5OPO4, Na0.5Rb0.5Ti0.5Sn0.5OPO4 and K0.5Rb0.5Ti0.5Sn0.5OPO4","Journal of Materials Chemistry","1992","2","","785","792","10.1039/JM9920200785","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","0.078","","","","","","","","","has coordinates","191789","2020-10-21","18:00:00",""
"7227627","13.1435","0.0005","10.6433","0.0003","6.5478","0.0003","90","","90","","90","","915.97","0.06","","","293","","","","","","","","","6","P n 21 a","P -2ac -2n","33","","","","- Na0.5 O5 P Rb0.5 Sn0.5 Ti0.5 -","- Na0.5 O5 P Rb0.5 Sn0.5 Ti0.5 -","- Na4 O40 P8 Rb4 Sn4 Ti4 -","8","2","","Crennel, Susan J.; Cheetham, Anthony K.; Kaduk, James, A.; Jarman, Richard H.","Isomorphous substitution in non-linear optical KTiOPO4: powder diffraction studies of K0.5Rb0.5SnOPO4, K0.5Na0.5Ti0.5Sn0.5OPO4, Na0.5Rb0.5Ti0.5Sn0.5OPO4 and K0.5Rb0.5Ti0.5Sn0.5OPO4","Journal of Materials Chemistry","1992","2","","785","792","10.1039/JM9920200785","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","0.1155","","","","","","","","","has coordinates","191790","2020-10-21","18:00:00",""
"7227628","13.044","0.0005","10.6304","0.0004","6.4961","0.0003","90","","90","","90","","900.77","0.06","","","293","","","","","","","","","6","P n 21 a","P -2ac -2n","33","","","","- K0.5 O5 P Rb0.5 Sn0.5 Ti0.5 -","- K0.5 O5 P Rb0.5 Sn0.5 Ti0.5 -","- K4 O40 P8 Rb4 Sn4 Ti4 -","8","2","","Crennel, Susan J.; Cheetham, Anthony K.; Kaduk, James, A.; Jarman, Richard H.","Isomorphous substitution in non-linear optical KTiOPO4: powder diffraction studies of K0.5Rb0.5SnOPO4, K0.5Na0.5Ti0.5Sn0.5OPO4, Na0.5Rb0.5Ti0.5Sn0.5OPO4 and K0.5Rb0.5Ti0.5Sn0.5OPO4","Journal of Materials Chemistry","1992","2","","785","792","10.1039/JM9920200785","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","0.0747","","","","","","","","","has coordinates","191791","2020-10-21","18:00:00",""
"7228257","7.5286","0.0001","7.5286","0.0001","7.5286","0.0001","90","","90","","90","","426.72","0.01","","","293","","","","","","","","","4","I 2 3","I 2 2 3","197","","","","- Cu2.667 Li2.667 Nb8 O24 -","- Cu2.664 Li2.664 Nb8 O24 -","- Cu2.664 Li2.664 Nb8 O24 -","1","0.0416667","","Mineo Sato; Yoshiki Hama","Structure of new perovskite-related compounds, LiCuM3O9 (M = Nb, Ta)","Journal of Materials Chemistry","1993","3","","233","236","10.1039/JM9930300233","powder diffraction","x-ray","1.54185","CuKα","","","","","","","","0.0271","0.0308","","","","","","","","has coordinates","196673","2020-10-21","18:00:00",""
"7228258","7.5178","0.0001","7.5178","0.0001","7.5178","0.0001","90","","90","","90","","424.886","0.01","","","293","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Cu2.667 Li2.667 O24 Ta8 -","- Cu2.67 Li2.67 O24 Ta8 -","- Cu2.67 Li2.67 O24 Ta8 -","1","0.0208333","","Mineo Sato; Yoshiki Hama","Structure of new perovskite-related compounds, LiCuM3O9 (M = Nb, Ta)","Journal of Materials Chemistry","1993","3","","233","236","10.1039/JM9930300233","powder diffraction","x-ray","1.54185","CuKα","","","","","","","","0.0328","0.0223","","","","","","","","has coordinates","196674","2020-10-21","18:00:00",""
"7228418","5.10555","0.00008","5.85403","0.00007","5.10587","0.00006","90","","110.039","0.001","90","","143.366","0.003","","","293","","","","","","","","","3","P 1 2/a 1","-P 2ya","13","","","","- Li3 O4 Ru -","- Li3 O4 Ru -","- Li6 O8 Ru2 -","2","0.5","","Bush, T. S.; Catlow, C. R. A.; Battle, P. D.","Evolutionary programming techniques for predicting inorganic crystal structures","Journal of Materials Chemistry","1995","5","","1269","1272","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.084","","","","","","","","has coordinates","197601","2020-10-21","18:00:00",""
"7228628","11.374","0.003","11.374","0.003","11.44","0.005","90","","90","","90","","1480","0.9","","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mo4 Na5 O16 Y -","- Mo4 Na5 O16 Y -","- Mo16 Na20 O64 Y4 -","4","0.25","","Stedman, Nicola J.; Cheetham, Anthony K.; Battle, Peter D.","Crystal structures of two sodium yttrium molybdates : NaY(MoO4)2 and Na5Y(MoO4)4","Journal of Materials Chemistry","1994","4","","707","711","","","x-ray","0.71069","MoKα","","","0.0314","","","0.0338","","","","","","","","","","","has coordinates","198360","2020-10-21","18:00:00",""
"7228629","5.1989","0.00005","5.1989","0.00005","11.3299","0.0001","90","","90","","90","","306.231","0.005","","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mo2 Na O8 Y -","- Mo2 Na O8 Y -","- Mo4 Na2 O16 Y2 -","2","0.125","","Stedman, Nicola J.; Cheetham, Anthony K.; Battle, Peter D.","Crystal structures of two sodium yttrium molybdates : NaY(MoO4)2 and Na5Y(MoO4)4","Journal of Materials Chemistry","1994","4","","707","711","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","0.0549","","","","","","","","has coordinates","198361","2020-10-21","18:00:00",""
"7229074","6.7101","0.0003","7.3152","0.0003","7.1746","0.0003","90","","112.372","0.002","90","","325.66","0.02","","","4","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- D2 Mn O5 P -","- D2 Mn O5 P -","- D8 Mn4 O20 P4 -","4","0.5","","Miguel A. G. Aranda; J. Paul Attfield; Sebastian Bruque; Fernando Palacio","Magnetic structures of MnPO4.D2O and MnAsO4.D2O from time-of-flight neutron powder diffraction data","Journal of Materials Chemistry","1992","2","","501","505","10.1039/JM9920200501","powder diffraction","neutron","","time-of-flight","","","","","","","","","","","","","","","","","has coordinates","200211","2020-10-21","18:00:00",""
"7229075","6.8707","0.0003","7.6958","0.0003","7.3121","0.0003","90","","112.221","0.002","90","","357.92","0.03","","","4","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- As D2 Mn O5 -","- As D2 Mn O5 -","- As4 D8 Mn4 O20 -","4","0.5","","Miguel A. G. Aranda; J. Paul Attfield; Sebastian Bruque; Fernando Palacio","Magnetic structures of MnPO4.D2O and MnAsO4.D2O from time-of-flight neutron powder diffraction data","Journal of Materials Chemistry","1992","2","","501","505","10.1039/JM9920200501","powder diffraction","neutron","","time-of-flight","","","","","","","","","","","","","","","","","has coordinates","200212","2020-10-21","18:00:00",""
"7238082","17.664","0.005","12.548","0.005","17.271","0.005","90","0.005","115.91","0.005","90","0.005","3443","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H28 Co N6 S2 -","- C38 H28 Co N6 S2 -","- C152 H112 Co4 N24 S8 -","4","1","","Guionneau, Philippe; Marchivie, Mathieu; Bravic, Georges; Létard, Jean-François; Chasseau, Daniel","Co(ii) molecular complexes as a reference for the spin crossover in Fe(ii) analogues","J. Mater. Chem.","2002","12","8","2546","","10.1039/B202610D","","","0.71069","MoKα","","0.0722","0.0387","","","0.0933","0.1079","","","","","","1.025","","","","has coordinates","244025","2020-10-21","18:00:00",""
"7238083","17.1637","0.0002","12.5575","0.0002","17.2701","0.0002","90","0.005","115.844","0.005","90","0.005","3349.99","0.16","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H28 Co N6 S2 -","- C38 H28 Co N6 S2 -","- C152 H112 Co4 N24 S8 -","4","1","","Guionneau, Philippe; Marchivie, Mathieu; Bravic, Georges; Létard, Jean-François; Chasseau, Daniel","Co(ii) molecular complexes as a reference for the spin crossover in Fe(ii) analogues","J. Mater. Chem.","2002","12","8","2546","","10.1039/B202610D","","","0.71069","MoKα","","0.0772","0.0389","","","0.0983","0.1427","","","","","","1.105","","","","has coordinates","244025","2020-10-21","18:00:00",""
"7238084","15.599","0.005","14.727","0.005","16.87","0.005","90","","93.65","0.05","90","","3868","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42.5 H30 Co N6 O0.5 S2 -","- C43 H28 Co N6 S2 -","- C172 H112 Co4 N24 S8 -","4","1","","Guionneau, Philippe; Marchivie, Mathieu; Bravic, Georges; Létard, Jean-François; Chasseau, Daniel","Co(ii) molecular complexes as a reference for the spin crossover in Fe(ii) analogues","J. Mater. Chem.","2002","12","8","2546","","10.1039/B202610D","","","0.71069","MoKα","","0.1045","0.0477","","","0.1169","0.1407","","","","","","1.02","","","","has coordinates","244025","2020-10-21","18:00:00",""
"7238085","15.674","0.003","14.599","0.003","16.844","0.003","90","","93.105","0.004","90","","3848.7","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H28 Co N6 S2 -","- C42 H28 Co N6 S2 -","- C168 H112 Co4 N24 S8 -","4","1","","Guionneau, Philippe; Marchivie, Mathieu; Bravic, Georges; Létard, Jean-François; Chasseau, Daniel","Co(ii) molecular complexes as a reference for the spin crossover in Fe(ii) analogues","J. Mater. Chem.","2002","12","8","2546","","10.1039/B202610D","","","0.71069","MoKα","","0.1656","0.0424","","","0.0841","0.1122","","","","","","0.944","","","","has coordinates","244025","2020-10-21","18:00:00",""
"7238086","15.6741","0.0007","14.3226","0.0006","16.7829","0.0008","90","","93.364","0.001","90","","3761.2","0.3","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H28 Co N6 S2 -","- C42 H28 Co N6 S2 -","- C168 H112 Co4 N24 S8 -","4","1","","Guionneau, Philippe; Marchivie, Mathieu; Bravic, Georges; Létard, Jean-François; Chasseau, Daniel","Co(ii) molecular complexes as a reference for the spin crossover in Fe(ii) analogues","J. Mater. Chem.","2002","12","8","2546","","10.1039/B202610D","","","0.71073","MoKα","","0.0706","0.0398","","","0.0896","0.1025","","","","","","1.017","","","","has coordinates","244025","2020-10-21","18:00:00",""
"7238378","11.209","0.002","12.6","0.003","14.572","0.003","91.81","0.03","111.78","0.03","107.79","0.03","1795.1","0.9","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C48 H34 N4 -","- C48 H34 N4 -","- C96 H68 N8 -","2","1","","Li, Yue-Qin; Fang, Run-Chen; Zheng, An-Min; Chu, Yue-Ying; Tao, Xian; Xu, Hui-Hua; Ding, Shi-Jin; Shen, Ying-Zhong","Nonvolatile memory devices based on polyimides bearing noncoplanar twisted biphenyl units containing carbazole and triphenylamine side-chain groups","Journal of Materials Chemistry","2011","21","39","15643","","10.1039/c1jm12453f","","","0.71073","MoKα","","0.1521","0.0825","","","0.173","0.2118","","","","","","1.155","","","","has coordinates","244151","2020-10-21","18:00:00",""
"7238379","14.0207","0.0002","9.8721","0.0001","19.5803","0.0003","90","","106.189","0.002","90","","2602.72","0.07","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C37 H25 N3 -","- C37 H25 N3 -","- C148 H100 N12 -","4","1","","Chen, You-Ming; Hung, Wen-Yi; You, Hong-Wei; Chaskar, Atul; Ting, Hao-Chun; Chen, Hsiao-Fan; Wong, Ken-Tsung; Liu, Yi-Hung","Carbazole‒benzimidazole hybrid bipolar host materials for highly efficient green and blue phosphorescent OLEDs","Journal of Materials Chemistry","2011","21","38","14971","","10.1039/c1jm12598b","","","1.54178","CuKα","","0.0424","0.0362","","","0.1153","0.1212","","","","","","1.047","","","","has coordinates","244152","2020-10-21","18:00:00",""
"7238380","9.758","0.0012","12.2984","0.0013","18.563","0.002","99.104","0.003","103.488","0.002","102.84","0.002","2059.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H48 N2 S4 -","- C48 H48 N2 S4 -","- C96 H96 N4 S8 -","2","1","","Nishinaga, Tohru; Miyata, Toshihiko; Tateno, Masaki; Koizumi, Masahide; Takase, Masayoshi; Iyoda, Masahiko; Kobayashi, Norihito; Kunugi, Yoshihito","Synthesis and structural, electronic, optical and FET properties of thiophene‒pyrrole mixed hexamers end-capped with phenyl and pentafluorophenyl groups","Journal of Materials Chemistry","2011","21","38","14959","","10.1039/c1jm12966j","","","0.71073","MoKα","","0.1222","0.055","","","0.118","0.1615","","","","","","0.991","","","","has coordinates,has disorder","244153","2020-10-21","18:00:00",""
"7238381","5.5928","0.0011","10.505","0.002","18.392","0.004","104.347","0.004","93.216","0.004","90.447","0.004","1045","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H43 F5 N2 S4 -","- C48 H38 F5 N2 S4 -","- C48 H38 F5 N2 S4 -","1","0.5","","Nishinaga, Tohru; Miyata, Toshihiko; Tateno, Masaki; Koizumi, Masahide; Takase, Masayoshi; Iyoda, Masahiko; Kobayashi, Norihito; Kunugi, Yoshihito","Synthesis and structural, electronic, optical and FET properties of thiophene‒pyrrole mixed hexamers end-capped with phenyl and pentafluorophenyl groups","Journal of Materials Chemistry","2011","21","38","14959","","10.1039/c1jm12966j","","","0.71073","MoKα","","0.0552","0.0461","","","0.1525","0.1632","","","","","","1.328","","","","has coordinates,has disorder","244153","2020-10-21","18:00:00",""
"7238533","12.3979","0.0003","8.9255","0.0004","10.8594","0.0005","90","","97.544","0.004","90","","1191.27","0.08","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 F N O7 P2 Zr -","- C5 F N O7 P2 Zr -","- C20 F4 N4 O28 P8 Zr4 -","4","1","","Donnadio, Anna; Pica, Monica; Taddei, Marco; Vivani, Riccardo","Design and synthesis of plasticizing fillers based on zirconium phosphonates for glycerol-free composite starch films","Journal of Materials Chemistry","2012","22","11","5098","","10.1039/c2jm15201k","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.08795","","4.93","","","","","","","has coordinates","244221","2020-10-21","18:00:00",""
"7238534","13.453","0.001","8.915","0.001","10.863","0.002","90","","106.51","0.01","90","","1249.1","0.3","373","","373","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 F N O7 P2 Zr -","- C6 F N O7 P2 Zr -","- C24 F4 N4 O28 P8 Zr4 -","4","1","","Donnadio, Anna; Pica, Monica; Taddei, Marco; Vivani, Riccardo","Design and synthesis of plasticizing fillers based on zirconium phosphonates for glycerol-free composite starch films","Journal of Materials Chemistry","2012","22","11","5098","","10.1039/c2jm15201k","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.06076","","4.61","","","","","","","has coordinates","244221","2020-10-21","18:00:00",""
"7238535","14.4786","0.0006","8.89","0.002","10.882","0.001","90","","93.86","0.02","90","","1397.5","0.3","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 F N O7 P2 Zr -","- C7 F N O7 P2 Zr -","- C28 F4 N4 O28 P8 Zr4 -","4","1","","Donnadio, Anna; Pica, Monica; Taddei, Marco; Vivani, Riccardo","Design and synthesis of plasticizing fillers based on zirconium phosphonates for glycerol-free composite starch films","Journal of Materials Chemistry","2012","22","11","5098","","10.1039/c2jm15201k","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.07569","","6.52","","","","","","","has coordinates","244221","2020-10-21","18:00:00",""
"7238536","26.2572","0.0017","7.2012","0.0003","10.3231","0.0005","90","","98.87","0.005","90","","1928.58","0.18","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H19 B F2 O4 -","- C21 H19 B F2 O4 -","- C84 H76 B4 F8 O16 -","4","0.5","","Sun, Xingxing; Zhang, Xuepeng; Li, Xinyang; Liu, Shiyong; Zhang, Guoqing","A mechanistic investigation of mechanochromic luminescent organoboron materials","Journal of Materials Chemistry","2012","22","33","17332","","10.1039/c2jm32809g","","","0.71073","MoKα","","0.0942","0.0541","","","0.1318","0.155","","","","","","1.05","","","","has coordinates","244222","2020-10-21","18:00:00",""
"7238537","10.6842","0.0007","7.2837","0.0004","12.8423","0.0007","90","","120.355","0.007","90","","862.39","0.11","291","2","291","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C19 H17 B F2 O4 -","- C19 H17 B F2 O4 -","- C38 H34 B2 F4 O8 -","2","1","","Sun, Xingxing; Zhang, Xuepeng; Li, Xinyang; Liu, Shiyong; Zhang, Guoqing","A mechanistic investigation of mechanochromic luminescent organoboron materials","Journal of Materials Chemistry","2012","22","33","17332","","10.1039/c2jm32809g","","","1.54184","CuKα","","0.0807","0.0727","","","0.1812","0.1899","","","","","","1.009","","","","has coordinates","244222","2020-10-21","18:00:00",""
"7238538","21.1856","0.0012","7.1155","0.0004","10.3692","0.0006","90","","96.363","0.005","90","","1553.49","0.15","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H15 B F2 O4 -","- C17 H15 B F2 O4 -","- C68 H60 B4 F8 O16 -","4","0.5","","Sun, Xingxing; Zhang, Xuepeng; Li, Xinyang; Liu, Shiyong; Zhang, Guoqing","A mechanistic investigation of mechanochromic luminescent organoboron materials","Journal of Materials Chemistry","2012","22","33","17332","","10.1039/c2jm32809g","","","0.71073","MoKα","","0.0642","0.0454","","","0.1163","0.1323","","","","","","1.047","","","","has coordinates","244222","2020-10-21","18:00:00",""
"7238539","7.5089","0.0004","14.414","0.0007","21.5562","0.001","90","","90","","90","","2333.1","0.2","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H24 Br3 N -","- C27 H24 Br3 N -","- C108 H96 Br12 N4 -","4","1","","Fang, Zhen; Chellappan, Vijila; Webster, Richard D.; Ke, Lin; Zhang, Tianfu; Liu, Bin; Lai, Yee-Hing","Bridged-triarylamine starburst oligomers as hole transporting materials for electroluminescent devices","Journal of Materials Chemistry","2012","22","30","15397","","10.1039/c2jm32840b","","","0.71073","MoKα","","0.0512","0.0373","","","0.0733","0.0771","","","","","","1.015","","","","has coordinates","244223","2020-10-21","18:00:00",""
"7238540","15.605","0.003","15.605","0.004","13.601","0.004","90","","90","","90","","3312.1","1.4","293","2","293","2","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","","","- C17 H24 N14 O2 Zn -","- C9 H3 N12 Zn -","- C36 H12 N48 Zn4 -","4","0.25","","Yang, Guang-Sheng; Li, Mei-Na; Li, Shun-Li; Lan, Ya-Qian; He, Wen-Wen; Wang, Xin-Long; Qin, Jun-Sheng; Su, Zhong-Min","Controllable synthesis of microporous, nanotubular and mesocage-like metal‒organic frameworks by adjusting the reactant ratio and modulated luminescence properties of Alq3@MOF composites","Journal of Materials Chemistry","2012","22","34","17947","","10.1039/c2jm32990e","","","0.71069","MoKα","","0.0829","0.0523","","","0.1418","0.1498","","","","","","0.971","","","","has coordinates","244224","2020-10-21","18:00:00",""
"7238541","29.667","0.004","29.667","0.004","22.161","0.006","90","","90","","120","","16891","6","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C131 H204 N90 O23 Zn7 -","- C78 H72 N78 O6 Zn7 -","- C234 H216 N234 O18 Zn21 -","3","0.166667","","Yang, Guang-Sheng; Li, Mei-Na; Li, Shun-Li; Lan, Ya-Qian; He, Wen-Wen; Wang, Xin-Long; Qin, Jun-Sheng; Su, Zhong-Min","Controllable synthesis of microporous, nanotubular and mesocage-like metal‒organic frameworks by adjusting the reactant ratio and modulated luminescence properties of Alq3@MOF composites","Journal of Materials Chemistry","2012","22","34","17947","","10.1039/c2jm32990e","","","0.71069","MoKα","","0.2034","0.1147","","","0.3185","0.382","","","","","","1.181","","","","has coordinates","244224","2020-10-21","18:00:00",""
"7238542","28.993","0.003","28.993","0.003","21.958","0.003","90","","90","","120","","15985","3","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C22 H35 Cl2 N15 O4 Zn2 -","- C9 H3 Cl2 N12 Zn2 -","- C162 H54 Cl36 N216 Zn36 -","18","0.5","","Yang, Guang-Sheng; Li, Mei-Na; Li, Shun-Li; Lan, Ya-Qian; He, Wen-Wen; Wang, Xin-Long; Qin, Jun-Sheng; Su, Zhong-Min","Controllable synthesis of microporous, nanotubular and mesocage-like metal‒organic frameworks by adjusting the reactant ratio and modulated luminescence properties of Alq3@MOF composites","Journal of Materials Chemistry","2012","22","34","17947","","10.1039/c2jm32990e","","","0.71073","MoKα","","0.1032","0.0643","","","0.2026","0.222","","","","","","1.09","","","","has coordinates","244224","2020-10-21","18:00:00",""
"7238543","14.707","0.002","5.1858","0.0008","17.973","0.003","90","","90","","90","","1370.8","0.4","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C18 H14 Co N4 -","- C18 H14 Co N4 -","- C72 H56 Co4 N16 -","4","1","","Whyte, Alexander M.; Shuku, Yoshiaki; Nichol, Gary S.; Matsushita, Michio M.; Awaga, Kunio; Robertson, Neil","Planar Ni(ii), Cu(ii) and Co(ii) tetraaza[14]annulenes: structural, electronic and magnetic properties and application to field effect transistors","Journal of Materials Chemistry","2012","22","34","17967","","10.1039/c2jm33079b","","","0.71073","MoKα","","0.084","0.0535","","","0.1272","0.1457","","","","","","1.062","","","","has coordinates","244225","2020-10-21","18:00:00",""
"7238544","9.385","0.0009","13.304","0.0012","15.3654","0.0011","74.895","0.007","81.155","0.007","75.541","0.008","1785.5","0.3","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C43 H36 Cl2 Co2 N8 -","- C43 H36 Cl2 Co2 N8 -","- C86 H72 Cl4 Co4 N16 -","2","1","","Whyte, Alexander M.; Shuku, Yoshiaki; Nichol, Gary S.; Matsushita, Michio M.; Awaga, Kunio; Robertson, Neil","Planar Ni(ii), Cu(ii) and Co(ii) tetraaza[14]annulenes: structural, electronic and magnetic properties and application to field effect transistors","Journal of Materials Chemistry","2012","22","34","17967","","10.1039/c2jm33079b","","","1.54184","CuKα","","0.0967","0.0833","","0.0767","0.0728","0.0728","","","","","","1.1254","","","","has coordinates,has disorder","244225","2020-10-21","18:00:00",""
"7238545","19.416","0.005","5.1511","0.0012","14.878","0.004","90","","112.394","0.003","90","","1375.8","0.6","150.1","","150.1","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Cu N4 -","- C18 H14 Cu N4 -","- C72 H56 Cu4 N16 -","4","1","","Whyte, Alexander M.; Shuku, Yoshiaki; Nichol, Gary S.; Matsushita, Michio M.; Awaga, Kunio; Robertson, Neil","Planar Ni(ii), Cu(ii) and Co(ii) tetraaza[14]annulenes: structural, electronic and magnetic properties and application to field effect transistors","Journal of Materials Chemistry","2012","22","34","17967","","10.1039/c2jm33079b","","","0.7107","MoKα","","","0.0364","","","","0.105","","","","","","1.065","","","","has coordinates","244225","2020-10-21","18:00:00",""
"7238546","20.428","0.004","12.905","0.002","6.973","0.0012","90","","90","","90","","1838.2","0.6","150.1","","150.1","","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C26 H18 N4 Ni -","- C26 H18 N4 Ni -","- C104 H72 N16 Ni4 -","4","0.5","","Whyte, Alexander M.; Shuku, Yoshiaki; Nichol, Gary S.; Matsushita, Michio M.; Awaga, Kunio; Robertson, Neil","Planar Ni(ii), Cu(ii) and Co(ii) tetraaza[14]annulenes: structural, electronic and magnetic properties and application to field effect transistors","Journal of Materials Chemistry","2012","22","34","17967","","10.1039/c2jm33079b","","","0.7107","MoKα","","","0.0377","","","","0.0962","","","","","","1.072","","","","has coordinates","244225","2020-10-21","18:00:00",""
"7238547","15.3573","0.0003","7.4862","0.0001","27.068","0.0005","90","","103.435","0.001","90","","3026.79","0.09","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C66 H74 Mg N6 O6 Si2 -","- C66 H74 Mg N6 O6 Si2 -","- C132 H148 Mg2 N12 O12 Si4 -","2","0.5","","Hatano, Junichi; Obata, Naoki; Yamaguchi, Shigeru; Yasuda, Takeshi; Matsuo, Yutaka","Soluble porphyrin donors for small molecule bulk heterojunction solar cells","Journal of Materials Chemistry","2012","22","36","19258","","10.1039/c2jm33956k","","","1.54187","CuKα","","0.1096","0.0775","","","0.2148","0.2465","","","","","","1.033","","","","has coordinates","244226","2020-10-21","18:00:00",""
"7238548","10.7018","0.0002","16.4164","0.0003","16.4397","0.0003","102.654","0.001","98.991","0.001","95.304","0.001","2759.28","0.09","123","2","123","2","","","","","","","","6","P -1","-P 1","2","MgTIPSTEP-Ph","DiphenylethynylBistriisopropylsilylethynelPorphyrinMg","","- C60 H68 Mg N4 O2 Si2 -","- C60 H68 Mg N4 O2 Si2 -","- C120 H136 Mg2 N8 O4 Si4 -","2","1","","Hatano, Junichi; Obata, Naoki; Yamaguchi, Shigeru; Yasuda, Takeshi; Matsuo, Yutaka","Soluble porphyrin donors for small molecule bulk heterojunction solar cells","Journal of Materials Chemistry","2012","22","36","19258","","10.1039/c2jm33956k","","","1.54187","CuKα","","0.2162","0.1206","","","0.3153","0.4209","","","","","","1.202","","","","has coordinates,has disorder","275222","2022-05-08","21:48:35",""
"7238549","10.7181","0.0013","17.865","0.003","41.906","0.004","90","","90","","90","","8024.1","1.8","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C48 H35 F6 Ir N6 O0.5 P -","- C48 H35 F6 Ir N6 O0.5 P -","- C384 H280 F48 Ir8 N48 O4 P8 -","8","1","","Tordera, Daniel; Pertegás, Antonio; Shavaleev, Nail M.; Scopelliti, Rosario; Ortí, Enrique; Bolink, Henk J.; Baranoff, Etienne; Grätzel, Michael; Nazeeruddin, Mohammad K.","Efficient orange light-emitting electrochemical cells","Journal of Materials Chemistry","2012","22","36","19264","","10.1039/c2jm33969b","","","0.71073","MoKα","","0.0552","0.0441","","","0.0777","0.0814","","","","","","1.174","","","","has coordinates","244227","2020-10-21","18:00:00",""
"9017502","6.0186","","4.7768","","10.4192","","90","","90.952","","90","","299.507","","","","59.7","","","","","","","","Synthetic","3","P 1 21/c 1","-P 2ybc","14","","","Sarcopside","- Fe3 O8 P2 -","- Fe3 O8 P2 -","- Fe6 O16 P4 -","2","0.5","","Warner, J. K.; Cheetham, A. K.; Nord, A. G.; Von Dreele, R. B.; Yethiraj, M.","Magnetic structure of iron(II) phosphate, sarcopside, Fe3(PO4)2 Sample: FE3(PO4)2 Note: T = 59.7 K","Journal of Materials Chemistry","1992","2","","191","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017503","6.01037","","4.7727","","10.4052","","90","","90.944","","90","","298.44","","","","10.1","","","","","","","","Synthetic","3","P 1 21/c 1","-P 2ybc","14","","","Sarcopside","- Fe3 O8 P2 -","- Fe3 O8 P2 -","- Fe6 O16 P4 -","2","0.5","","Warner, J. K.; Cheetham, A. K.; Nord, A. G.; Von Dreele, R. B.; Yethiraj, M.","Magnetic structure of iron(II) phosphate, sarcopside, Fe3(PO4)2 Sample: FE3(PO4)2 Note: T = 10.1 K","Journal of Materials Chemistry","1992","2","","191","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""