# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-17T13:37:40+02:00
# 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 'Chemistry of Materials') AND volume = 20 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
"4001080","9.976","0.0013","11.281","0.0013","15.387","0.002","70.76","0.008","81.138","0.008","84.7","0.009","1613.8","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H50 N4 O2 -","- C37 H50 N4 O2 -","- C74 H100 N8 O4 -","2","1","","Cardinaels, Thomas; Ramaekers, Jan; Nockemann, Peter; Driesen, Kris; Van Hecke, Kristof; Van Meervelt, Luc; Lei, Shengbin; De Feyter, Steven; Guillon, Daniel; Donnio, Bertrand; Binnemans, Koen","Imidazo[4,5-f]-1,10-phenanthrolines: Versatile Ligands for the Design of Metallomesogens","Chemistry of Materials","2008","20","4","1278","","10.1021/cm070637i","","","1.54178","CuKα","","0.1271","0.0682","","","0.1607","0.196","","","","","","0.994","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001081","10.8917","0.0008","15.677","0.0011","15.9877","0.0008","117.819","0.003","97.656","0.004","93.066","0.005","2371.9","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H36 Eu F9 N4 O9 S3 -","- C45.774 H36 Eu F9 N4 O9 S3 -","- C91.548 H72 Eu2 F18 N8 O18 S6 -","2","1","","Cardinaels, Thomas; Ramaekers, Jan; Nockemann, Peter; Driesen, Kris; Van Hecke, Kristof; Van Meervelt, Luc; Lei, Shengbin; De Feyter, Steven; Guillon, Daniel; Donnio, Bertrand; Binnemans, Koen","Imidazo[4,5-f]-1,10-phenanthrolines: Versatile Ligands for the Design of Metallomesogens","Chemistry of Materials","2008","20","4","1278","","10.1021/cm070637i","","","1.54178","CuKα","","0.0674","0.0581","","","0.1403","0.1454","","","","","","0.975","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001082","8.89","0.006","10.729","0.007","13.263","0.008","81.23","0.04","71.34","0.04","80.52","0.04","1175.4","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H19 Br N5 O4 Re -","- C25 H19 Br N5 O4 Re -","- C50 H38 Br2 N10 O8 Re2 -","2","1","","Cardinaels, Thomas; Ramaekers, Jan; Nockemann, Peter; Driesen, Kris; Van Hecke, Kristof; Van Meervelt, Luc; Lei, Shengbin; De Feyter, Steven; Guillon, Daniel; Donnio, Bertrand; Binnemans, Koen","Imidazo[4,5-f]-1,10-phenanthrolines: Versatile Ligands for the Design of Metallomesogens","Chemistry of Materials","2008","20","4","1278","","10.1021/cm070637i","","","1.54178","CuKα","","0.0774","0.0556","","","0.1529","0.1803","","","","","","1.019","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001083","7.1145","0.0004","25.8569","0.0015","43.551","0.003","90","","90","","90","","8011.6","0.9","295","2","295","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C17 H9 F6 In O5 -","- C17 H9 F6 In O5 -","- C272 H144 F96 In16 O80 -","16","0.5","","Gándara, F.; Gomez-Lor, B.; Gutiérrez-Puebla, E.; Iglesias, M.; Monge, M. A.; Proserpio, D. M.; Snejko, N.","An Indium Layered MOF as Recyclable Lewis Acid Catalyst","Chemistry of Materials","2008","20","1","72","","10.1021/cm071079a","","","0.71073","MoKα","","0.0849","0.072","","","0.1435","0.1478","","","","","","1.421","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001084","7.1213","0.0005","25.8933","0.0017","43.629","0.003","90","","90","","90","","8044.9","1","295","2","295","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C20 H9 F6 In O5 -","- C20 H9 F6 In O5 -","- C320 H144 F96 In16 O80 -","16","0.5","","Gándara, F.; Gomez-Lor, B.; Gutiérrez-Puebla, E.; Iglesias, M.; Monge, M. A.; Proserpio, D. M.; Snejko, N.","An Indium Layered MOF as Recyclable Lewis Acid Catalyst","Chemistry of Materials","2008","20","1","72","","10.1021/cm071079a","","","0.71073","MoKα","","0.0864","0.0643","","","0.1076","0.1135","","","","","","1.264","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001085","5.84039","0.0001","5.84039","","6.06707","0.00017","90","","90","","120","","179.223","0.006","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","- Mo O8 W Zr -","- Mo O8 W Zr -","- Mo O8 W Zr -","1","0.0833333","","Deng, Xuebin; Tao, Juzhou; Yang, Xiaojing; Ma, Hui; Richardson, James W.; Zhao, Xinhua","Novel Trigonal ZrWMoO8Structure and Its Transformations","Chemistry of Materials","2008","20","5","1733","","10.1021/cm071605y","powder diffraction","x-ray","1.54187","CuKα","","","","","","","","0.08807","","2.98","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001086","9.87224","0.00008","9.87224","","17.54547","0.00024","90","","90","","120","","1480.9","0.02","","","","","","","","","","","","4","R -3 :H","-R 3","148","","","","- Mo O8 W Zr -","- Mo O8 W Zr -","- Mo9 O72 W9 Zr9 -","9","0.5","","Deng, Xuebin; Tao, Juzhou; Yang, Xiaojing; Ma, Hui; Richardson, James W.; Zhao, Xinhua","Novel Trigonal ZrWMoO8Structure and Its Transformations","Chemistry of Materials","2008","20","5","1733","","10.1021/cm071605y","powder diffraction","neutron","","","","","","","","","","0.03225","","1.28","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001087","13.3098","0.0004","13.3098","0.0004","27.436","0.0018","90","","90","","120","","4209.2","0.3","299","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","TAF24-IMI","","","- C24 H40 F24 N16 O12 Ta8 -","- C18 H30 F24 N12 O12 Ta8 -","- C54 H90 F72 N36 O36 Ta24 -","3","0.166667","","Alam, Todd M.; Clawson, Jacalyn S.; Bonhomme, François; Thoma, Steven G.; Rodriguez, Mark A.; Zheng, Shaohui; Autschbach, Jochen","A Solid-State NMR, X-ray Diffraction, and Ab Initio Investigation into the Structures of Novel Tantalum Oxyfluoride Clusters","Chemistry of Materials","2008","20","6","2205","","10.1021/cm0717763","","","0.71073","MoKα","","0.0319","0.0297","","","0.0601","0.0612","","","","","","1.23","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001088","9.0476","0.0012","15.897","0.002","10.823","0.0015","90","","92.327","0.002","90","","1555.4","0.4","168","2","168","2","","","","","","","","6","I 1 2/m 1","-I 2y","12","TAF16-PYR","","","- C20 H24 F16 N4 O4 Ta4 -","- C10 H12 F16 N2 O4 Ta4 -","- C20 H24 F32 N4 O8 Ta8 -","2","0.25","","Alam, Todd M.; Clawson, Jacalyn S.; Bonhomme, François; Thoma, Steven G.; Rodriguez, Mark A.; Zheng, Shaohui; Autschbach, Jochen","A Solid-State NMR, X-ray Diffraction, and Ab Initio Investigation into the Structures of Novel Tantalum Oxyfluoride Clusters","Chemistry of Materials","2008","20","6","2205","","10.1021/cm0717763","","","0.71073","MoKα","","0.0398","0.0386","","","0.0897","0.0902","","","","","","1.24","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001089","9.257","0.004","15.918","0.006","10.923","0.004","90","","92.915","0.007","90","","1607.5","1.1","298","2","298","2","","","","","","","","6","I 1 2/m 1","-I 2y","12","TAF16-PYR - RT","","","- C20 H24 F16 N4 O4 Ta4 -","- C10 H12 F16 N2 O4 Ta4 -","- C20 H24 F32 N4 O8 Ta8 -","2","0.25","","Alam, Todd M.; Clawson, Jacalyn S.; Bonhomme, François; Thoma, Steven G.; Rodriguez, Mark A.; Zheng, Shaohui; Autschbach, Jochen","A Solid-State NMR, X-ray Diffraction, and Ab Initio Investigation into the Structures of Novel Tantalum Oxyfluoride Clusters","Chemistry of Materials","2008","20","6","2205","","10.1021/cm0717763","","","0.71073","MoKα","","0.0311","0.026","","","0.0631","0.0647","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001090","7.4573","0.0002","18.0966","0.0005","14.0233","0.0004","90","","99.254","0.001","90","","1867.84","0.09","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Zeolite STF- template removed using SQUEEZE","","","- F O32 Si16 -","- F O32 Si16 -","- F2 O64 Si32 -","2","0.5","","Wragg, David S.; Morris, Russell E.; Burton, Allen W.","Pure Silica Zeolite-type Frameworks: A Structural Analysis","Chemistry of Materials","2008","20","4","1561","","10.1021/cm071824j","","","0.6892","","","0.0768","0.0607","","","0.1454","0.1508","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001091","7.5018","0.0007","12.116","0.0012","26.764","0.002","90","","97.467","0.002","90","","2412","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C0.63 H0.38 N0.13 O0.06 -","- C2.5 H1.5 N0.5 O0.25 -","- C120 H72 N24 O12 -","48","12","","Zafiropoulos, Nicholas A.; Choi, E-Joon; Dingemans, Theo; Lin, Wenbin; Samulski, Edward T.","New All-Aromatic Liquid Crystal Architectures","Chemistry of Materials","2008","20","12","3821","","10.1021/cm701862w","","","0.71073","MoKα","","0.0901","0.0515","","","0.1223","0.1384","","","","","","0.994","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001092","3.83","0.001","11.069","0.002","7.157","0.001","90","","90","","90","","303.42","0.11","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- C Gd Ru2 Si -","- C Gd Ru2 Si -","- C4 Gd4 Ru8 Si4 -","4","0.25","","Fickenscher, Thomas; Rayaprol, Sudhindra; Appen, Jörg von; Dronskowski, Richard; Pöttgen, Rainer; Łat̀ka, Kazimierz; Gurgul, Jacek","Crystal Structure, Chemical Bonding, and Magnetic Hyperfine Interactions in GdRu2SiC","Chemistry of Materials","2008","20","4","1381","","10.1021/cm7020406","","","0.71073","MoKα","","0.0242","0.0179","","","0.0346","0.0363","","","","","","1.13","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001093","3.9595","0.0001","3.9595","0.0001","19.2227","0.0003","90","","90","","90","","301.367","0.012","240","2","240","2","","","","","","","synthesis as described","6","P 4/n m m :2","-P 4a 2a","129","Barium strontium manganese copper oxide sulfide","Barium strontium manganese copper oxide sulfide","","- Ba2.64 Cu1.96 Mn4 O8 S2 Sr1.36 -","- Ba2.64 Cu1.956 Mn4 O8 S2 Sr1.36 -","- Ba2.64 Cu1.956 Mn4 O8 S2 Sr1.36 -","1","0.0625","","Hyett, Geoffrey; Gál, Zoltán A.; Smura, Catherine F.; Clarke, Simon J.","Ba2Mn2O4Cu0.9S: A layered Oxysulfide with a New Perovskite-Related Manganese Oxide Fragment","Chemistry of Materials","2008","20","2","559","","10.1021/cm7021054","","x-ray","0.71073","MoKα","","0.0214","0.0207","","","0.0517","0.052","","","","","","1.26","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001094","15.141","0.002","15.141","0.002","9.3313","0.0019","90","","90","","120","","1852.6","0.5","293","2","293","2","","","","","","","","5","P 63 c m","P 6c -2","185","","","","- C3 H31 Co8 O34 P9 -","- C3 H15 Co8 O34.02 P9 -","- C6 H30 Co16 O68.04 P18 -","2","0.166667","","Zhao, Lang; Li, Jiyang; Chen, Peng; Li, Guanghua; Yu, Jihong; Xu, Ruren","2H3O·[Co8(HPO3)9(CH3OH)3]·2H2O: An Open-Framework Cobalt Phosphite Containing Extra-Large 18-Ring Channels","Chemistry of Materials","2008","20","1","17","","10.1021/cm7021906","","","0.71073","MoKα","","0.0637","0.056","","","0.1546","0.1602","","","","","","1.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001095","34.39","0.0003","9.982","0.0002","19.165","0.0007","90","","104.996","0.001","90","","6354.9","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H60 Fe N6 O2 -","- C81 H60 Fe N6 O2 -","- C324 H240 Fe4 N24 O8 -","4","1","","Chiang, Chao Cheng; Chen, Hong-Chun; Lee, Chin-sheng; Leung, Man-kit; Lin, Kun-Rung; Hsieh, Kuo-Huang","Electrochemical Deposition of Bis(N,N′-diphenylaminoaryl) Substituted Ferrocenes, and Their Application as a Hole-Injection Layer on Polymeric Light-Emitting Diodes","Chemistry of Materials","2008","20","2","540","","10.1021/cm702217u","","","0.71073","MoKα","","0.1344","0.0631","","0.1963","0.1485","","","","1.046","1.11","1.11","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001096","7.326","0.0001","27.768","0.0003","11.572","0.0001","90","","100.063","0.001","90","","2317.86","0.05","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H16 Br2 Fe N4 O2 -","- C26 H16 Br2 Fe N4 O2 -","- C104 H64 Br8 Fe4 N16 O8 -","4","1","","Chiang, Chao Cheng; Chen, Hong-Chun; Lee, Chin-sheng; Leung, Man-kit; Lin, Kun-Rung; Hsieh, Kuo-Huang","Electrochemical Deposition of Bis(N,N′-diphenylaminoaryl) Substituted Ferrocenes, and Their Application as a Hole-Injection Layer on Polymeric Light-Emitting Diodes","Chemistry of Materials","2008","20","2","540","","10.1021/cm702217u","","","0.71073","MoKα","","0.062","0.0389","","0.1419","0.1142","","","","0.975","0.925","0.925","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001097","7.9522","0.0016","10.827","0.002","14.369","0.003","109.02","0.03","91.8","0.03","103.57","0.03","1129.1","0.5","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H25 Fe N -","- C30 H25 Fe N -","- C60 H50 Fe2 N2 -","2","1","","Chiang, Chao Cheng; Chen, Hong-Chun; Lee, Chin-sheng; Leung, Man-kit; Lin, Kun-Rung; Hsieh, Kuo-Huang","Electrochemical Deposition of Bis(N,N′-diphenylaminoaryl) Substituted Ferrocenes, and Their Application as a Hole-Injection Layer on Polymeric Light-Emitting Diodes","Chemistry of Materials","2008","20","2","540","","10.1021/cm702217u","","","0.71073","MoKα","","0.14","0.0562","","","0.1081","0.1384","","","","","","1.002","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001098","12.991","0.003","18.174","0.004","21.696","0.004","67.58","0.03","88.4","0.03","89.16","0.03","4733","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H64 Al2 Ba O8 -","- C48 H64 Al2 Ba O8 -","- C192 H256 Al8 Ba4 O32 -","4","2","","John, Łukasz; Utko, Józef; Szafert, Sławomir; Jerzykiewicz, Lucjan B.; Kȩpiński, Leszek; Sobota, Piotr","Synthesis and Characterization of Mixed-Metal Aryloxo-Organometallic Precursors for Oxide‒Ceramic Materials","Chemistry of Materials","2008","20","13","4231","4239","10.1021/cm702262n","","","0.71073","MoKα","","0.0488","0.0334","","","0.0777","0.0868","","","","","","1.036","","","","has coordinates","218801","2020-10-21","18:00:00",""
"4001099","12.474","0.005","17.861","0.005","20.432","0.005","90","0.05","103.26","0.05","90","0.05","4431","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H56 Ba Ga2 O8 -","- C44 H56 Ba Ga2 O8 -","- C176 H224 Ba4 Ga8 O32 -","4","0.5","","John, Łukasz; Utko, Józef; Szafert, Sławomir; Jerzykiewicz, Lucjan B.; Kȩpiński, Leszek; Sobota, Piotr","Synthesis and Characterization of Mixed-Metal Aryloxo-Organometallic Precursors for Oxide‒Ceramic Materials","Chemistry of Materials","2008","20","13","4231","4239","10.1021/cm702262n","","","0.71073","MoKα","","0.0229","0.0186","","","0.046","0.0473","","","","","","1.058","","","","has coordinates,has disorder","218801","2020-10-21","18:00:00",""
"4001100","10.508","0.005","11.444","0.005","19.927","0.005","89.19","0.04","82.22","0.05","70.33","0.05","2234.4","1.7","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C44 H54 Ba O8 Zn2 -","- C44 H54 Ba O8 Zn2 -","- C88 H108 Ba2 O16 Zn4 -","2","1","","John, Łukasz; Utko, Józef; Szafert, Sławomir; Jerzykiewicz, Lucjan B.; Kȩpiński, Leszek; Sobota, Piotr","Synthesis and Characterization of Mixed-Metal Aryloxo-Organometallic Precursors for Oxide‒Ceramic Materials","Chemistry of Materials","2008","20","13","4231","4239","10.1021/cm702262n","","","0.71073","MoKα","","0.0365","0.0288","","","0.0685","0.0708","","","","","","1.065","","","","has coordinates","218801","2020-10-21","18:00:00",""
"4001101","7.6492","0.0003","5.258","0.0002","9.0485","0.0003","90","","101.742","0.002","90","","356.31","0.02","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- H2 K O9 S2 Ti -","- H2 K O9 S2 Ti -","- H4 K2 O18 S4 Ti2 -","2","0.5","","Nilsen, G. J.; Rønnow, H. M.; Läuchli, A. M.; Fabbiani, F. P. A.; Sanchez-Benitez, J.; Kamenev, K. V.; Harrison, A.","A New Realisation of theS= 1/2 Frustrated Chain Antiferromagnet","Chemistry of Materials","2008","20","1","8","","10.1021/cm7023263","","","0.71073","MoKα","","0.0353","0.0334","","0.0978","0.0947","0.0978","","","","","","1.0474","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001102","18.8","0.003","18.8","0.003","14.147","0.003","90","","90","","120","","4330.2","1.3","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C27 H100.5 F4.5 Ge21 N15 Ni2 O51.5 -","- C27 H60 F4.758 Ge21 N15 Ni2 O51.798 -","- C54 H120 F9.516 Ge42 N30 Ni4 O103.596 -","2","0.166667","","Pan, Qinhe; Li, Jiyang; Ren, Xiaoyan; Wang, Zhuopeng; Li, Guanghua; Yu, Jihong; Xu, Ruren","[Ni(1,2-PDA)3]2(HOCH2CH2CH2NH3)3(H3O)2[Ge7O14X3]3(X= F, OH): A New 1D Germanate with 12-Ring Hexagonal Tubular Channels","Chemistry of Materials","2008","20","2","370","","10.1021/cm702439v","","","0.71073","MoKα","","0.058","0.0459","","","0.1167","0.1228","","","","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001103","5.738938","0.000032","5.738938","","23.64154","0.00015","90","","90","","120","","674.325","0.006","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba5 In0.94 Mn4 O14.42 -","- Ba5 In0.94399 Mn4 O14.416 -","- Ba10 In1.88798 Mn8 O28.832 -","2","0.0833333","","Yin, Congling; Li, Guobao; Jin, Tounan; You, Liping; Tao, Julian; Richardson, James W.; Loong, Chun-K.; Sun, Junliang; Liao, Fuhui; Lin, Jianhua","Synthesis, Structure, and Characterization of the Hexagonal Provskite Ba5In0.93Mn4O14.40","Chemistry of Materials","2008","20","6","2110","","10.1021/cm7025152","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001104","4.429","0.0006","4.429","0.0006","28.36","0.006","90","","90","","120","","481.78","0.14","293","2","293","2","","","","","","","","2","R -3 m :H","-R 3 2""","166","tin phosphide","","","- P4.04 Sn3 -","- P4.04 Sn3 -","- P12.12 Sn9 -","3","0.0833333","","Zaikina, Julia V.; Kovnir, Kirill A.; Sobolev, Alexey N.; Presniakov, Igor A.; Kytin, Vladimir G.; Kulbachinskii, Vladimir A.; Olenev, Andrei V.; Lebedev, Oleg I.; Tendeloo, Gustaaf Van; Dikarev, Evgeny V.; Shevelkov, Andrei V.","Highly Disordered Crystal Structure and Thermoelectric Properties of Sn3P4","Chemistry of Materials","2008","20","7","2476","","10.1021/cm702655g","","","0.71073","MoKα","","0.0239","0.0226","","","0.057","0.0577","","","","","","1.168","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001105","9.1657","0.0004","10.0618","0.0004","10.7584","0.0004","73.668","0.001","65.366","0.001","65.916","0.001","815.95","0.06","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C4 H17 F3 N3 O12 P3 U2 -","- C4 H16 F3 N3 O12 P3 U2 -","- C8 H32 F6 N6 O24 P6 U4 -","2","1","","Lai, Yu-Lun; Chiang, Ray-Kuang; Lii, Kwang-Hwa; Wang, Sue-Lein","The First Organically Templated Tetravalent Uranium Phosphates with Dimer-Structured Topologies","Chemistry of Materials","2008","20","2","523","","10.1021/cm7027959","","","0.71073","MoKα","","0.0281","0.0247","","","0.0528","0.0542","","","","","","1.052","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001106","11.1124","0.0004","19.683","0.0008","10.1466","0.0004","90","","114.362","0.001","90","","2021.71","0.14","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C6 H23 F4 N4 O12 P3 U2 -","- C6 H18 F4 N3.99 O12 P3 U2 -","- C24 H72 F16 N15.96 O48 P12 U8 -","4","1","","Lai, Yu-Lun; Chiang, Ray-Kuang; Lii, Kwang-Hwa; Wang, Sue-Lein","The First Organically Templated Tetravalent Uranium Phosphates with Dimer-Structured Topologies","Chemistry of Materials","2008","20","2","523","","10.1021/cm7027959","","","0.71073","MoKα","","0.0328","0.0271","","","0.0606","0.0629","","","","","","0.918","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001107","18.3826","0.0013","7.8448","0.0006","18.4421","0.0013","90","","113.967","0.001","90","","2430.2","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H34 F10 N6 O8 P2 U2 -","- C8 H2 F10 N6 O8 P2 U2 -","- C32 H8 F40 N24 O32 P8 U8 -","4","1","","Lai, Yu-Lun; Chiang, Ray-Kuang; Lii, Kwang-Hwa; Wang, Sue-Lein","The First Organically Templated Tetravalent Uranium Phosphates with Dimer-Structured Topologies","Chemistry of Materials","2008","20","2","523","","10.1021/cm7027959","","","0.71073","MoKα","","0.0425","0.0288","","","0.0635","0.0666","","","","","","0.84","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001108","10.2346","0.0009","23.846","0.002","8.8091","0.0008","90","","93.459","0.002","90","","2146","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H34 F7 N4 O4 P U -","- C12 H14 F7 N4 O4 P U -","- C48 H56 F28 N16 O16 P4 U4 -","4","1","","Lai, Yu-Lun; Chiang, Ray-Kuang; Lii, Kwang-Hwa; Wang, Sue-Lein","The First Organically Templated Tetravalent Uranium Phosphates with Dimer-Structured Topologies","Chemistry of Materials","2008","20","2","523","","10.1021/cm7027959","","","0.71073","MoKα","","0.0751","0.0382","","","0.0917","0.1012","","","","","","0.901","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001109","12.3784","0.0016","5.9718","0.0008","15.209","0.002","90","","91.924","0.002","90","","1123.6","0.3","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H6 Cu3 N12 O12 V4 -","- C10 H6 Cu3 N12 O12 V4 -","- C20 H12 Cu6 N24 O24 V8 -","2","0.5","","Li, Jian-Rong; Yu, Qun; Sañudo, E. Carolina; Tao, Ying; Song, Wei-Chao; Bu, Xian-He","Three-Dimensional Homospin Inorganic‒Organic Ferrimagnet Constructed from (VO3‒)nChains Linking {[5-(Pyrimidin-2-yl)tetrazolato-(CuII)1.5]2+}nLayers","Chemistry of Materials","2008","20","4","1218","","10.1021/cm702938q","","","0.71073","MoKα","","0.0248","0.0207","","","0.0534","0.0556","","","","","","1.074","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001110","11.278","0.002","5.033","0.0011","14.307","0.003","90","","92.006","0.004","90","","811.6","0.3","100","2","170","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H10 S4 -","- C22 H10 S4 -","- C44 H20 S8 -","2","0.5","","Brusso, Jaclyn L.; Hirst, Oliver D.; Dadvand, Afshin; Ganesan, Srinivasan; Cicoira, Fabio; Robertson, Craig M.; Oakley, Richard T.; Rosei, Federico; Perepichka, Dmitrii F.","Two-Dimensional Structural Motif in Thienoacene Semiconductors: Synthesis, Structure, and Properties of Tetrathienoanthracene Isomers","Chemistry of Materials","2008","20","7","2484","","10.1021/cm7030653","","","0.71073","MoKα","","0.059","0.0464","","","0.1103","0.1186","","","","","","1.065","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001111","12.3815","0.0014","5.257","0.0006","12.7975","0.0015","90","","97.753","0.002","90","","825.37","0.16","100","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H10 S4 -","- C22 H10 S4 -","- C44 H20 S8 -","2","0.5","","Brusso, Jaclyn L.; Hirst, Oliver D.; Dadvand, Afshin; Ganesan, Srinivasan; Cicoira, Fabio; Robertson, Craig M.; Oakley, Richard T.; Rosei, Federico; Perepichka, Dmitrii F.","Two-Dimensional Structural Motif in Thienoacene Semiconductors: Synthesis, Structure, and Properties of Tetrathienoanthracene Isomers","Chemistry of Materials","2008","20","7","2484","","10.1021/cm7030653","","","0.71073","MoKα","","0.0612","0.0553","","","0.1349","0.1392","","","","","","1.1","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001112","6.951343","0.000033","6.951343","","10.76111","0.00006","90","","90","","90","","519.989","0.004","","","","","","","","","","","","3","P 4/n c c :2","-P 4a 2ac","130","","","","- O5 Si Sr3 -","- O5 Si Sr3 -","- O20 Si4 Sr12 -","4","0.25","","Porras-Vázquez, José M.; Losilla, Enrique R.; León-Reina, Laura; Martínez-Lara, María; Aranda, Miguel A. G.","Synthesis and Characterization of a New Family of Mixed Oxide−Proton Conductors Based on Tristrontium Oxysilicate","Chemistry of Materials","2008","20","5","2026","","10.1021/cm703079d","powder diffraction","","","","","","","","","","","","","2.27","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001113","6.9427","0.00014","6.9427","","10.79916","0.00025","90","","90","","90","","520.531","0.016","","","","","","","","","","","","4","P 4/n c c :2","-P 4a 2ac","130","","","","- Al0.04 O4.98 Si0.96 Sr3 -","- Al0.038 O4.981 Si0.962 Sr3 -","- Al0.152 O19.924 Si3.848 Sr12 -","4","0.25","","Porras-Vázquez, José M.; Losilla, Enrique R.; León-Reina, Laura; Martínez-Lara, María; Aranda, Miguel A. G.","Synthesis and Characterization of a New Family of Mixed Oxide−Proton Conductors Based on Tristrontium Oxysilicate","Chemistry of Materials","2008","20","5","2026","","10.1021/cm703079d","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001114","5.2355","0.0003","12.7396","0.0008","19.1626","0.0011","90","","91.17","0.001","90","","1277.84","0.13","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Ba2 Gd3 Li3 Mo8 O32 Yb0 -","- Ba2 Gd2.9 Li2.86 Mo8 O32 Yb0.24 -","- Ba4 Gd5.8 Li5.72 Mo16 O64 Yb0.48 -","2","0.25","","García-Cortés, Alberto; Cascales, Concepción","Crystal Growth and Optical and Spectroscopic Characterization of the Ytterbium-Doped Laser Molybdate Yb−Li3Gd3Ba2(MoO4)8","Chemistry of Materials","2008","20","12","3884","","10.1021/cm703138x","","","0.71073","MoKα","","0.0524","0.0446","","","0.1069","0.1127","","","","","","1.21","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001115","8.61468","0.00016","8.61468","","3.81019","0.00016","90","","90","","90","","282.765","0.013","293","2","","","","","","","","","","3","P 4/m","-P 4","83","","","","- Mn5 O13 Sr5 -","- Mn5 O13 Sr5 -","- Mn5 O13 Sr5 -","1","0.125","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001116","8.6209","0.0005","12.1263","0.0004","3.8091","0.00017","90","","90","","98.1793","0.0029","394.15","0.03","298","2","","","","","","","","","","3","P 1 1 2/m","-P 2","10","","","","- Mn7 O19.62 Sr7 -","- Mn7 O19.619 Sr7 -","- Mn7 O19.619 Sr7 -","1","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001117","8.60611","0.00011","8.60611","","3.83812","0.00007","90","","90","","90","","284.271","0.006","293","2","","","","","","","","","","4","P 4/m","-P 4","83","","","","- La0.5 Mn5 O13.7 Sr4.5 -","- La0.5 Mn5 O13.698 Sr4.5 -","- La0.5 Mn5 O13.698 Sr4.5 -","1","0.125","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001118","3.843","0.0005","3.843","","3.843","","90","","90","","90","","56.756","0.007","293","2","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- La0.2 Mn O2.86 Sr0.8 -","- La0.2 Mn O2.8581 Sr0.8 -","- La0.2 Mn O2.8581 Sr0.8 -","1","0.0208333","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001119","8.681","0.0018","8.681","","3.8585","0.0008","90","","90","","90","","290.78","0.09","773","5","","","","","","","","","","4","P 4/m","-P 4","83","","","","- La0.5 Mn5 O13 Sr4.5 -","- La0.5 Mn5 O13 Sr4.5 -","- La0.5 Mn5 O13 Sr4.5 -","1","0.125","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001120","5.5786","0.0016","10.9046","0.0032","3.8684","0.0011","90","","90","","90","","235.32","0.12","773","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.4 Mn4 O10.2 Sr3.6 -","- La0.4 Mn4 O10.2 Sr3.6 -","- La0.4 Mn4 O10.2 Sr3.6 -","1","0.125","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001121","5.5902","0.001","10.8814","0.0019","3.8793","0.0007","90","","90","","90","","235.97","0.07","773","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.2 Mn2 O5 Sr1.8 -","- La0.2 Mn2 O5 Sr1.8 -","- La0.4 Mn4 O10 Sr3.6 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001122","5.60595","0.00012","10.92454","0.00025","3.88944","0.00011","90","","90","","90","","238.199","0.01","973","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.2 Mn4 O5 Sr1.8 -","- La0.2 Mn2 O5 Sr1.8 -","- La0.4 Mn4 O10 Sr3.6 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001123","3.93138","0.00004","3.93138","","3.93138","","90","","90","","90","","60.7624","0.0006","1173","5","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- La0.1 Mn O2.5 Sr0.9 -","- La0.1 Mn O2.49999 Sr0.9 -","- La0.1 Mn O2.49999 Sr0.9 -","1","0.0208333","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001124","8.73091","0.00028","8.73091","","7.70497","0.00028","90","","90","","90","","587.34","0.03","773","5","","","","","","","","","","4","P 42/m","-P 4c","84","","","","- La Mn5 O13 Sr4 -","- La3.4 Mn5 O13 Sr1.6 -","- La6.8 Mn10 O26 Sr3.2 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","1.24","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001125","3.91357","0.00008","3.91357","","3.91357","","90","","90","","90","","59.9404","0.0012","1073","5","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- La0.2 Mn O2.58 Sr0.8 -","- La0.2 Mn O2.58 Sr0.8 -","- La0.2 Mn O2.58 Sr0.8 -","1","0.0208333","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001126","5.5674","0.0021","10.798","0.004","3.8903","0.0014","90","","90","","90","","233.87","0.15","573","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.4 Mn2 O5 Sr1.6 -","- La0.4 Mn2 O5 Sr1.6 -","- La0.8 Mn4 O10 Sr3.2 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001127","8.7206","0.0032","8.7206","","7.7289","0.0028","90","","90","","90","","587.8","0.3","573","5","","","","","","","","","","4","P 42/m","-P 4c","84","","","","- La Mn5 O13 Sr4 -","- La Mn5 O13 Sr4 -","- La2 Mn10 O26 Sr8 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001128","19.785","0.003","7.2793","0.0009","9.9663","0.0013","90","","90","","90","","1435.4","0.3","298","2","298","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- Co3 H10 Na2 O18 S3 -","- Co3 H10 Na2 O18 S3 -","- Co12 H40 Na8 O72 S12 -","4","0.5","","Zhang, Xian-Ming; Li, Cui-Rui; Zhang, Xu-Hui; Zhang, Wei-Xiong; Chen, Xiao-Ming","Unusual Slow Magnetic Relaxation in Helical Co3(OH)2Ferrimagnetic Chain Based Cobalt Hydroxysulfates","Chemistry of Materials","2008","20","6","2298","","10.1021/cm7032542","","","0.71073","MoKα","","0.03","0.0281","","","0.0692","0.0705","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001129","18.25","0.004","7.5988","0.0016","9.813","0.002","90","","90","","90","","1360.8","0.5","298","2","298","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- Co3 H12 O18 S3 -","- Co3 H12 O18 S3 -","- Co12 H48 O72 S12 -","4","0.5","","Zhang, Xian-Ming; Li, Cui-Rui; Zhang, Xu-Hui; Zhang, Wei-Xiong; Chen, Xiao-Ming","Unusual Slow Magnetic Relaxation in Helical Co3(OH)2Ferrimagnetic Chain Based Cobalt Hydroxysulfates","Chemistry of Materials","2008","20","6","2298","","10.1021/cm7032542","","","0.71073","MoKα","","0.0292","0.0266","","","0.0609","0.062","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001130","7.179","0.002","14.634","0.005","22.134","0.007","90","","91.121","0.014","90","","2324.9","1.3","296.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H28 Co3 N24 O6 W2 -","- C32 H16 Co3 N24 O6 W2 -","- C64 H32 Co6 N48 O12 W4 -","2","0.5","","Ohkoshi, Shin-ichi; Hamada, Yoshiho; Matsuda, Tomoyuki; Tsunobuchi, Yoshihide; Tokoro, Hiroko","Crystal Structure, Charge-Transfer-Induced Spin Transition, and Photoreversible Magnetism in a Cyano-Bridged Cobalt−Tungstate Bimetallic Assembly","Chemistry of Materials","2008","20","9","3048","","10.1021/cm703258n","","","0.71075","MoKα","","","0.0976","","","","0.2241","","","","","","0.987","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001131","4.7402","0.0003","11.6558","0.0007","12.7944","0.0007","72.455","0.005","85.757","0.005","84.292","0.005","669.95","0.07","110","","110","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H14 F12 N2 O4 -","- C32 H14 F12 N2 O4 -","- C32 H14 F12 N2 O4 -","1","0.5","","See, Kevin C.; Landis, Chad; Sarjeant, Amy; Katz, Howard E.","Easily Synthesized Naphthalene Tetracarboxylic Diimide Semiconductors with High Electron Mobility in Air","Chemistry of Materials","2008","20","11","3609","","10.1021/cm7032614","","","0.71073","MoKα","","0.0779","0.0418","","","0.0899","0.0971","","","","","","1.003","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001132","10.521","0.002","10.521","0.002","10.521","0.002","90","","90","","90","","1164.6","0.4","293","1","293","1","","","","","","","see text","7","F -4 3 m","F -4 2 3","216","","","","- C6 H2 Fe Mn N6 O Rb -","- C6 Fe Mn N6 O1.001 Rb1.001 -","- C24 Fe4 Mn4 N24 O4.004 Rb4.004 -","4","0.0416667","","Vertelman, Esther J. M.; Lummen, Tom T. A.; Meetsma, Auke; Bouwkamp, Marco W.; Molnar, Gabor; van Loosdrecht, Paul H. M.; van Koningsbruggen, Petra J.","Light- and Temperature-Induced Electron Transfer in Single Crystals of RbMn[Fe(CN)6]·H2O","Chemistry of Materials","2008","20","4","1236","","10.1021/cm7032965","","","0.71073","MoKα","","0.0366","0.0348","","","0.0981","0.1004","","","","","","1.287","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001133","4.2022","0.0013","15.935","0.005","4.0247","0.0012","90","","90","","90","","269.5","0.14","120","2","120","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Ge0.98 Sn1.02 Tm -","- Ge0.98 Sn1.02 Tm -","- Ge3.92 Sn4.08 Tm4 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.0175","0.0173","","","0.0418","0.0419","","","","","","1.374","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001134","3.997","0.0007","15.719","0.003","3.8604","0.0007","90","","90","","90","","242.54","0.08","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Ge2 Tm -","- Ge2 Tm -","- Ge8 Tm4 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.0191","0.0185","","","0.0415","0.0416","","","","","","1.253","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001135","4.3005","0.0009","16.441","0.004","4.0944","0.0009","90","","90","","90","","289.49","0.11","120","2","120","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Gd Ge0.83 Sn1.17 -","- Gd Ge0.831 Sn1.169 -","- Gd4 Ge3.324 Sn4.676 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.0204","0.0195","","","0.0471","0.0476","","","","","","1.277","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001136","4.266","0.002","16.293","0.008","4.062","0.002","90","","90","","90","","282.3","0.2","120","2","120","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Ge0.89 Sn1.11 Tb -","- Ge0.887 Sn1.113 Tb -","- Ge3.548 Sn4.452 Tb4 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.0272","0.0237","","","0.057","0.0589","","","","","","1.113","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001137","4.251","0.002","16.197","0.008","4.0584","0.0019","90","","90","","90","","279.4","0.2","120","2","120","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Dy Ge0.91 Sn1.09 -","- Dy Ge0.917 Sn1.083 -","- Dy4 Ge3.668 Sn4.332 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.026","0.0226","","","0.0513","0.0529","","","","","","1.128","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001138","4.2473","0.0018","16.127","0.007","4.0693","0.0017","90","","90","","90","","278.7","0.2","120","2","120","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Ge0.9 Ho Sn1.1 -","- Ge0.903 Ho Sn1.097 -","- Ge3.612 Ho4 Sn4.388 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.022","0.0159","","","0.0335","0.0367","","","","","","1.044","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001139","4.209","0.003","16.006","0.01","4.029","0.003","90","","90","","90","","271.4","0.3","120","2","120","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Er Ge0.92 Sn1.08 -","- Er Ge0.921 Sn1.079 -","- Er4 Ge3.684 Sn4.316 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.0259","0.0248","","","0.0548","0.0553","","","","","","1.159","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001140","4.2511","0.0014","16.296","0.005","4.0633","0.0013","90","","90","","90","","281.49","0.16","120","2","120","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Ge0.86 Sn1.14 Y -","- Ge0.871 Sn1.129 Y -","- Ge3.484 Sn4.516 Y4 -","4","0.25","","Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.","Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group","Chemistry of Materials","2008","20","6","2151","","10.1021/cm7033799","","","0.71073","MoKα","","0.0208","0.0204","","","0.0475","0.0478","","","","","","1.209","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001141","4.236","0.0003","4.236","","23.7609","0.0017","90","","90","","120","","369.24","0.04","90","","90","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","- Ge Sb4 Te7 -","- Ge Sb4 Te7 -","- Ge Sb4 Te7 -","1","0.0833333","","Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki","Structural Features of Ge1Sb4Te7, an Intermetallic Compound in the GeTe-Sb2Te3Homologous Series","Chemistry of Materials","2008","20","18","5750","","10.1021/cm703484k","powder diffraction","","0.42986","synchrotron","","","","","","","","","0.005","4.86","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001142","3.948","0.002","11.007","0.006","27.36","0.01","90","","90.278","0.009","90","","1188.9","1","293.1","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 S4 -","- C32 H18 S4 -","- C64 H36 S8 -","2","0.5","","Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun","Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes","Chemistry of Materials","2008","20","15","4883","","10.1021/cm703499q","","","0.7107","MoKα","","","0.1163","","","","0.3397","","","","","","1.141","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001143","14.192","0.014","6.135","0.005","15.912","0.017","90","","116.158","0.016","90","","1244","2","293.1","","","","","","","","","","","3","P 1 2/n 1","-P 2yac","13","","","","- C32 H18 S4 -","- C32 H18 S3.82 -","- C64 H36 S7.64 -","2","0.5","","Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun","Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes","Chemistry of Materials","2008","20","15","4883","","10.1021/cm703499q","","","0.7107","MoKα","","","0.1144","","","","0.2415","","","","","","1.26","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001144","11.971","0.004","3.944","0.001","35.7","0.01","90","","90.454","0.003","90","","1685.5","0.9","293.1","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H14 S2 -","- C24 H14 S2 -","- C96 H56 S8 -","4","1","","Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun","Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes","Chemistry of Materials","2008","20","15","4883","","10.1021/cm703499q","","","0.7107","MoKα","","","0.0861","","","","0.2644","","","","","","1.153","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4001145","7.88","0.01","11.44","0.02","18.11","0.03","90","","90","","90","","1633","4","293.1","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C24 H14 S2 -","- C24 H14 S2 -","- C96 H56 S8 -","4","0.5","","Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun","Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes","Chemistry of Materials","2008","20","15","4883","","10.1021/cm703499q","","","0.7107","MoKα","","","0.1199","","","","0.2969","","","","","","1.327","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001146","10.5791","0.0009","11.0987","0.0013","14.1662","0.0012","71.53","0.004","75.669","0.003","84.702","0.005","1528.4","0.3","118","","","","","","","","","","","7","P -1","-P 1","2","","","","- C19 H19 Cu Dy F12 N4 O9 -","- C19 H19 Cu Dy F12 N4 O9 -","- C38 H38 Cu2 Dy2 F24 N8 O18 -","2","1","","Okazawa, Atsushi; Nogami, Takashi; Nojiri, Hiroyuki; Ishida, Takayuki","Exchange Coupling and Energy-Level Crossing in a Magnetic Chain [Dy2Cu2]nEvaluated by High-Frequency Electron Paramagnetic Resonance","Chemistry of Materials","2008","20","9","3110","","10.1021/cm703530n","","","0.71069","MoKα","","","0.0615","","","","0.0889","","","","","","1.172","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001147","19.371","0.005","22.47","0.005","24.009","0.005","90","","107.886","0.005","90","","9945","4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C90 H146 Cl2 Fe4 O20 -","- C90 H134 Cl2 Fe4 O20 -","- C360 H536 Cl8 Fe16 O80 -","4","0.5","","Condorelli, Guglielmo G.; Motta, Alessandro; Pellegrino, Giovanna; Cornia, Andrea; Gorini, Lapo; Fragalà, Ignazio L.; Sangregorio, Claudio; Sorace, Lorenzo","Site-Specific Anchoring of Tetrairon(III) Single Molecule Magnets on Functionalized Si(100) Surfaces","Chemistry of Materials","2008","20","6","2405","","10.1021/cm703561c","","","0.71069","MoKα","","0.1276","0.0769","","","0.2036","0.2328","","","","","","1.001","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001148","16.5899","0.0003","16.5899","0.0003","21.909","0.0009","90","","90","","90","","6029.9","0.3","90","2","90","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- Mn0.78 Sb11 Yb14 Zn0.22 -","- Mn0.78 Sb11 Yb14 Zn0.22 -","- Mn6.24 Sb88 Yb112 Zn1.76 -","8","0.25","","Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey","Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering","Chemistry of Materials","2008","20","10","3412","","10.1021/cm703616q","","","0.71073","MoKα","","0.0344","0.0259","","","0.0638","0.0666","","","","","","1.139","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001149","16.5883","0.0007","16.5883","0.0007","21.9115","0.0017","90","","90","","90","","6029.4","0.6","90","2","90","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- Mn0.77 Sb11 Yb14 Zn0.23 -","- Mn0.77 Sb11 Yb14 Zn0.23 -","- Mn6.16 Sb88 Yb112 Zn1.84 -","8","0.25","","Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey","Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering","Chemistry of Materials","2008","20","10","3412","","10.1021/cm703616q","","","0.71073","MoKα","","0.0315","0.0229","","","0.0556","0.0585","","","","","","1.153","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001150","16.5776","0.0007","16.5776","0.0007","21.8888","0.0019","90","","90","","90","","6015.4","0.6","93","2","93","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- Mn0.67 Sb11 Yb14 Zn0.33 -","- Mn0.67 Sb11 Yb14 Zn0.33 -","- Mn5.36 Sb88 Yb112 Zn2.64 -","8","0.25","","Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey","Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering","Chemistry of Materials","2008","20","10","3412","","10.1021/cm703616q","","","0.71073","MoKα","","0.0296","0.0286","","","0.0729","0.0734","","","","","","1.151","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001151","16.5893","0.0006","16.5893","0.0006","21.8917","0.0015","90","","90","","90","","6024.7","0.5","90","2","90","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- Mn0.32 Sb11 Yb14 Zn0.68 -","- Mn0.32 Sb11 Yb14 Zn0.68 -","- Mn2.56 Sb88 Yb112 Zn5.44 -","8","0.25","","Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey","Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering","Chemistry of Materials","2008","20","10","3412","","10.1021/cm703616q","","","0.71073","MoKα","","0.0274","0.0262","","","0.0672","0.0677","","","","","","1.182","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001152","16.581","0.0006","16.581","0.0006","21.8748","0.0015","90","","90","","90","","6014","0.5","90","2","90","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- Mn0.19 Sb11 Yb14 Zn0.81 -","- Mn0.19 Sb11 Yb14 Zn0.81 -","- Mn1.52 Sb88 Yb112 Zn6.48 -","8","0.25","","Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey","Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering","Chemistry of Materials","2008","20","10","3412","","10.1021/cm703616q","","","0.71073","MoKα","","0.0345","0.0246","","","0.0566","0.0602","","","","","","1.198","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001153","5.486","","5.486","","13.4539","","90","","90","","120","","350.663","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Ce0.445 O3 Sr0.352 Ti -","- Ce0.448 O3 Sr0.352 Ti -","- Ce2.688 O18 Sr2.112 Ti6 -","6","0.166667","","Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas","Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series","Chemistry of Materials","2008","20","9","3127","","10.1021/cm703659f","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001154","5.5005","","5.5005","","13.4797","","90","","90","","120","","353.196","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Ce0.269 O3 Sr0.601 Ti -","- Ce0.269 O3 Sr0.601 Ti -","- Ce1.614 O18 Sr3.606 Ti6 -","6","0.166667","","Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas","Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series","Chemistry of Materials","2008","20","9","3127","","10.1021/cm703659f","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001155","5.5062","","5.5062","","13.4989","","90","","90","","120","","354.432","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Ce0.167 O3 Sr0.744 Ti -","- Ce0.167 O3 Sr0.744 Ti -","- Ce1.002 O18 Sr4.464 Ti6 -","6","0.166667","","Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas","Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series","Chemistry of Materials","2008","20","9","3127","","10.1021/cm703659f","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001156","5.5091","","5.5091","","13.5071","","90","","90","","120","","355.021","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Ce0.133 O3 Sr0.795 Ti -","- Ce0.132 O3 Sr0.795 Ti -","- Ce0.792 O18 Sr4.77 Ti6 -","6","0.166667","","Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas","Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series","Chemistry of Materials","2008","20","9","3127","","10.1021/cm703659f","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001157","6.6764","0.0003","7.0684","0.0003","7.8103","0.0003","111.141","0.002","95.415","0.002","90.457","0.002","341.89","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C H5 O7 P Pr -","- C H5 O7 P Pr -","- C2 H10 O14 P2 Pr2 -","2","1","","Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa","Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)","Chemistry of Materials","2008","20","9","2857","","10.1021/cm703703n","","","0.71073","MoKα","","0.0242","0.021","","","0.0423","0.0432","","","","","","1.063","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001158","6.6544","0.0002","7.038","0.0002","7.7938","0.0003","111.16","0.002","95.307","0.002","90.59","0.002","338.57","0.02","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C H5 Nd O7 P -","- C H5 Nd O7 P -","- C2 H10 Nd2 O14 P2 -","2","1","","Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa","Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)","Chemistry of Materials","2008","20","9","2857","","10.1021/cm703703n","","","0.71073","MoKα","","0.0248","0.0235","","","0.0618","0.0627","","","","","","1.093","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001159","6.5619","0.0002","6.9442","0.0003","7.7412","0.0004","111.369","0.003","95.495","0.002","90.824","0.002","326.52","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C H5 Eu O7 P -","- C H5 Eu O7 P -","- C2 H10 Eu2 O14 P2 -","2","1","","Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa","Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)","Chemistry of Materials","2008","20","9","2857","","10.1021/cm703703n","","","0.71073","MoKα","","0.038","0.0284","","","0.0454","0.0479","","","","","","1.022","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001160","6.5434","0.0002","6.9311","0.0002","7.7465","0.0003","111.487","0.001","95.645","0.002","90.833","0.002","324.839","0.019","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C H5 Gd O7 P -","- C H5 Gd O7 P -","- C2 H10 Gd2 O14 P2 -","2","1","","Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa","Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)","Chemistry of Materials","2008","20","9","2857","","10.1021/cm703703n","","","0.71073","MoKα","","0.0189","0.0179","","","0.0465","0.0471","","","","","","1.097","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001161","6.4628","0.0002","6.8519","0.0002","7.6936","0.0002","111.646","0.001","95.779","0.001","91.028","0.001","314.497","0.016","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C H5 Ho O7 P -","- C H5 Ho O7 P -","- C2 H10 Ho2 O14 P2 -","2","1","","Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa","Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)","Chemistry of Materials","2008","20","9","2857","","10.1021/cm703703n","","","0.71073","MoKα","","0.0204","0.0191","","","0.0467","0.0475","","","","","","1.096","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001162","6.44","0.0003","6.8326","0.0004","7.6747","0.0005","111.654","0.004","95.757","0.004","91.096","0.004","311.71","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C H5 Er O7 P -","- C H5 Er O7 P -","- C2 H10 Er2 O14 P2 -","2","1","","Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa","Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)","Chemistry of Materials","2008","20","9","2857","","10.1021/cm703703n","","","0.71073","MoKα","","0.0427","0.033","","","0.0591","0.0606","","","","","","1.047","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001163","6.4075","0.0005","6.805","0.0007","7.6647","0.0008","111.753","0.002","95.858","0.002","91.204","0.001","308.16","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C H5 O7 P Yb -","- C H5 O7 P Yb -","- C2 H10 O14 P2 Yb2 -","2","1","","Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa","Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)","Chemistry of Materials","2008","20","9","2857","","10.1021/cm703703n","","","0.71073","MoKα","","0.0345","0.0291","","","0.0638","0.0649","","","","","","1.075","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001164","20.1007","0.0007","20.1007","0.0007","20.1007","0.0007","90","","90","","90","","8121.4","0.5","273","2","273","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- B1.5 H3.42 Na O7.96 P V0.5 -","- B1.5 H0.5 Na O7.95833 P V0.5 -","- B72 H24 Na48 O382 P48 V24 -","48","1","","Yang, Weiting; Li, Jiyang; Pan, Qinhe; Jin, Zhao; Yu, Jihong; Xu, Ruren","Na2[VB3P2O12(OH)]·2.92H2O: A New Open-Framework Vanadium Borophosphate Containing Extra-Large 16-Ring Pore Openings and 128166Super Cavities Synthesized by Using the Boric Acid Flux Method","Chemistry of Materials","2008","20","15","4900","","10.1021/cm8000283","","","0.71073","MoKα","","0.083","0.0728","","","0.2165","0.2287","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001165","7.751","0.002","8.1021","0.0015","8.987","0.002","90","","112.67","0.03","90","","520.8","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Au N5 O14 -","- Au N5 O14 -","- Au2 N10 O28 -","2","0.5","","Wickleder, Mathias S.; Büchner, Oliver; Gerlach, Frauke; Necke, Mandus; Al-Shamery, Katharina; Wich, Thomas; Luttermann, Tim","Synthesis, Characterization and Electron Beam Assisted Decomposition of (NO2)[Au(NO3)4]","Chemistry of Materials","2008","20","16","5181","","10.1021/cm800066r","","","0.71073","MoKα","","0.0985","0.0337","","","0.0534","0.0622","","","","","","0.805","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001166","11.7433","0.0001","11.7433","0.0001","4.1857","0.0001","90","","90","","120","","499.895","0.013","293","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Gd6 Ni1.667 Si3 -","- Gd6 Ni1.668 Si3 -","- Gd12 Ni3.336 Si6 -","2","0.166667","","Gaudin, Etienne; Tencé, Sophie; Weill, François; Rodriguez Fernandez, Jesus; Chevalier, Bernard","Structural and Magnetocaloric Properties of the New Ternary Silicides Gd6M5/3Si3with M = Co and Ni","Chemistry of Materials","2008","20","9","2972","","10.1021/cm8000859","","","0.71069","MoKα","","0.0466","0.0324","","","0.0686","0.0745","","","","1.07","1.07","1.06","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001167","11.7123","0.0004","11.7123","0.0004","4.1705","0.0002","90","","90","","120","","495.45","0.03","120","","120","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Gd6 Ni1.667 Si3 -","- Gd6 Ni1.666 Si3 -","- Gd12 Ni3.332 Si6 -","2","0.166667","","Gaudin, Etienne; Tencé, Sophie; Weill, François; Rodriguez Fernandez, Jesus; Chevalier, Bernard","Structural and Magnetocaloric Properties of the New Ternary Silicides Gd6M5/3Si3with M = Co and Ni","Chemistry of Materials","2008","20","9","2972","","10.1021/cm8000859","","","0.71069","MoKα","","0.0378","0.0262","","","0.0583","0.0617","","","","1.04","1.04","1.02","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001168","15.599","0.005","15.599","0.005","6.246","0.005","90","0.005","90","0.005","120","0.005","1316.2","1.2","293","2","293","2","","","","","","","","4","P 32","P 32","145","","","","- C20 H26 N2 O -","- C20 H26 N2 O -","- C60 H78 N6 O3 -","3","1","","Sliwa, Michel; Spangenberg, Arnaud; Malfant, Isabelle; Lacroix, Pascal G.; Métivier, Rémi; Pansu, Robert B.; Nakatani, Keitaro","Structural, Optical, and Theoretical Studies of a Thermochromic Organic Crystal with Reversibly Variable Second Harmonic Generation","Chemistry of Materials","2008","20","12","4062","","10.1021/cm800093a","","","0.71073","MoKα","","0.0464","0.0356","","","0.0761","0.0793","","","","","","0.958","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4001169","6.289","0.003","8.009","0.003","18.625","0.007","78.018","0.008","88.648","0.009","89.537","0.008","917.4","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","aobtc","","","- C32 H46 N6 O13 -","- C32 H46 N6 O13 -","- C32 H46 N6 O13 -","1","0.5","","Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai","Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes","Chemistry of Materials","2008","20","9","3145","","10.1021/cm800403d","","","0.71073","MoKα","","0.1649","0.0926","","","0.2617","0.2956","","","","","","1.459","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001170","18.814","0.015","18.814","0.015","30.58","0.04","90","","90","","120","","9374","16","213","2","213","2","","","","","","","","5","R -3 :H","-R 3","148","PCN-10","","","- C16 H10 Cu2 N2 O10 -","- C16 H10 Cu2 N2 O10 -","- C144 H90 Cu18 N18 O90 -","9","0.5","","Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai","Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes","Chemistry of Materials","2008","20","9","3145","","10.1021/cm800403d","","","0.71073","MoKα","","0.0803","0.0577","","","0.1441","0.1537","","","","","","1.007","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001171","7.32","0.007","10.709","0.01","12.668","0.01","65.56","0.018","89.18","0.02","88.097","0.019","903.6","1.4","476","2","476","2","","","","","","","","4","P -1","-P 1","2","sbtc","","","- C34 H48 N4 O12 -","- C34 H48 N4 O12 -","- C34 H48 N4 O12 -","1","0.5","","Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai","Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes","Chemistry of Materials","2008","20","9","3145","","10.1021/cm800403d","","","0.71073","MoKα","","0.1289","0.118","","","0.3004","0.3105","","","","","","1.248","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001172","18.795","0.003","18.795","0.003","31.28","0.009","90","","90","","120","","9569","3","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","PCN-11","","","- C18 H12 Cu2 O10 -","- C18 H12 Cu2 O10 -","- C162 H108 Cu18 O90 -","9","0.5","","Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai","Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes","Chemistry of Materials","2008","20","9","3145","","10.1021/cm800403d","","","0.71073","MoKα","","0.2457","0.0994","","","0.1984","0.2408","","","","","","0.934","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001173","7.941","0.0002","6.7131","0.0001","17.7867","0.0003","90","","95.269","0.002","90","","944.18","0.03","100","2","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","azidoformamidinium 1-methyl-5-nitriminotetrazolate","azidoformamidinium 1-methyl-5-nitriminotetrazolate","","- C3 H7 N11 O2 -","- C3 H7 N11 O2 -","- C12 H28 N44 O8 -","4","1","","Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.","Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials","Chemistry of Materials","2008","20","13","4519","","10.1021/cm8004166","","","0.71073","MoKα","","0.039","0.0298","","","0.0676","0.0735","","","","","","1.081","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001174","10.774","0.0003","8.4315","0.0002","6.4111","0.0002","90","","103.816","0.003","90","","565.54","0.03","100","2","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","silver 1-methyl-5-nitriminotetrazolate","silver 1-methyl-5-nitriminotetrazolate","","- C2 H3 Ag N6 O2 -","- C2 H3 Ag N6 O2 -","- C8 H12 Ag4 N24 O8 -","4","1","","Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.","Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials","Chemistry of Materials","2008","20","13","4519","","10.1021/cm8004166","","","0.71073","MoKα","","0.0244","0.019","","","0.0473","0.0494","","","","","","1.076","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001175","7.081","0.002","7.3612","0.0018","10.515","0.003","80.68","0.02","88.59","0.02","74.05","0.02","519.9","0.3","100","2","200","","","","","","","","","4","P -1","-P 1","2","diaminoguanidinium 1-methyl-5-nitriminotetrazolate monohydrate","diaminoguanidinium 1-methyl-5-nitriminotetrazolate monohydrate","","- C3 H13 N11 O3 -","- C3 H13 N11 O3 -","- C6 H26 N22 O6 -","2","1","","Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.","Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials","Chemistry of Materials","2008","20","13","4519","","10.1021/cm8004166","","","0.71073","MoKα","","0.0414","0.0315","","","0.0841","0.0889","","","","","","1.106","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001176","21.2356","0.0008","6.8969","0.0002","12.1761","0.0004","90","","102.457","0.002","90","","1741.33","0.1","200","2","200","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","guanidinium 1-methyl-5-nitriminotetrazolate","guanidinium 1-methyl-5-nitriminotetrazolate","","- C3 H9 N9 O2 -","- C3 H9 N9 O2 -","- C24 H72 N72 O16 -","8","1","","Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.","Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials","Chemistry of Materials","2008","20","13","4519","","10.1021/cm8004166","","","0.71073","MoKα","","0.0578","0.0487","","","0.1311","0.1359","","","","","","1.155","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001177","6.865","0.0002","7.98","0.0002","10.518","0.0003","101.311","0.002","103.776","0.002","103.123","0.002","525.6","0.03","200","2","200","2","","","","","","","","4","P -1","-P 1","2","Triaminoguanidinium 1-methyl-5-nitriminotetrazolate","Triaminoguanidinium 1-methyl-5-nitriminotetrazolate","","- C3 H12 N12 O2 -","- C3 H12 N12 O2 -","- C6 H24 N24 O4 -","2","1","","Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.","Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials","Chemistry of Materials","2008","20","13","4519","","10.1021/cm8004166","","","0.71073","MoKα","","0.0385","0.0354","","","0.1098","0.1131","","","","","","1.19","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001178","7.8548","0.0009","7.8548","0.0009","44.184","0.007","90","","90","","120","","2360.8","0.5","298","","298","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Ag19 Br7 Te6 -","- Ag18.964 Br7 Te6 -","- Ag56.892 Br21 Te18 -","3","0.0833333","","Nilges, Tom; Messel, Julia; Bawohl, Melanie; Lange, Stefan","Silver(I) Chalcogenide Halides Ag19Te6Br7, Ag19Te6Br5.4I1.6, and Ag19Te5SeBr7","Chemistry of Materials","2008","20","12","4080","","10.1021/cm800425u","","","0.71073","MoKα","","0.1182","0.0728","","","0.098","0.1018","","","","2.53","2.53","1.82","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001179","13.604","0.002","7.857","0.002","15.395","0.002","90","","107.13","0.01","90","","1572.5","0.5","298","","298","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ag19 Br7 Te6 -","- Ag18.988 Br7 Te6 -","- Ag37.976 Br14 Te12 -","2","0.25","","Nilges, Tom; Messel, Julia; Bawohl, Melanie; Lange, Stefan","Silver(I) Chalcogenide Halides Ag19Te6Br7, Ag19Te6Br5.4I1.6, and Ag19Te5SeBr7","Chemistry of Materials","2008","20","12","4080","","10.1021/cm800425u","","","0.71073","MoKα","","0.1254","0.043","","","0.0492","0.0607","","","","1.85","1.85","1.15","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001180","15.442","0.003","7.889","0.002","26.089","0.004","90","","90","","90","","3178.2","1.1","298","","298","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Ag19 Br5.438 I1.562 Te6 -","- Ag18.987 Br5.43 I1.57 Te6 -","- Ag75.948 Br21.72 I6.28 Te24 -","4","0.5","","Nilges, Tom; Messel, Julia; Bawohl, Melanie; Lange, Stefan","Silver(I) Chalcogenide Halides Ag19Te6Br7, Ag19Te6Br5.4I1.6, and Ag19Te5SeBr7","Chemistry of Materials","2008","20","12","4080","","10.1021/cm800425u","","","0.71073","MoKα","","0.1596","0.0417","","","0.0498","0.0667","","","","1.57","1.57","0.84","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001181","15.298","0.002","38.847","0.004","7.83","0.001","90","","90","","90","","4653.2","1","298","","298","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ag19 Br7 Se0.961 Te5.039 -","- Ag19.0173 Br7 Se0.96 Te5.04 -","- Ag114.104 Br42 Se5.76 Te30.24 -","6","0.75","","Nilges, Tom; Messel, Julia; Bawohl, Melanie; Lange, Stefan","Silver(I) Chalcogenide Halides Ag19Te6Br7, Ag19Te6Br5.4I1.6, and Ag19Te5SeBr7","Chemistry of Materials","2008","20","12","4080","","10.1021/cm800425u","","","0.71073","MoKα","","0.2469","0.022","","","0.0216","0.0503","","","","0.43","0.43","0.47","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001182","9.683","0.00011","13.31784","0.00015","9.59151","0.00011","90","","90","","90","","1236.89","0.02","11","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.03318","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001183","9.68301","0.00011","13.31962","0.00015","9.59143","0.00011","90","","90","","90","","1237.05","0.02","50","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.03287","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001184","9.68232","0.00012","13.32028","0.00017","9.59088","0.00012","90","","90","","90","","1236.95","0.03","100","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.03348","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001185","9.68078","0.00007","13.32122","0.0001","9.58941","0.00007","90","","90","","90","","1236.65","0.016","150","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","","","","","","","","","","","","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001186","9.67845","0.00008","13.32378","0.00011","9.58721","0.00008","90","","90","","90","","1236.31","0.018","200","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","","","","","","","","","","","","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001187","9.67514","0.00007","13.32701","0.00009","9.58449","0.00007","90","","90","","90","","1235.83","0.015","250","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","","","","","","","","","","","","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001188","9.67137","0.00007","13.32622","0.00009","9.58112","0.00007","90","","90","","90","","1234.84","0.015","300","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.04158","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001189","9.66691","0.00006","13.33095","0.00008","9.57804","0.00006","90","","90","","90","","1234.31","0.013","350","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.04486","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001190","9.66276","0.00006","13.33496","0.00008","9.57504","0.00006","90","","90","","90","","1233.77","0.013","400","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.0452","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001191","9.65894","0.00006","13.33824","0.00008","9.57242","0.00006","90","","90","","90","","1233.25","0.013","450","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.04699","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001192","9.65542","0.00005","13.34124","0.00007","9.57","0.00005","90","","90","","90","","1232.76","0.011","500","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.049","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001193","9.65196","0.00005","13.34383","0.00007","9.56777","0.00005","90","","90","","90","","1232.27","0.011","550","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.05101","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001194","9.64871","0.00005","13.34598","0.00007","9.56563","0.00005","90","","90","","90","","1231.78","0.011","600","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.05444","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001195","9.64531","0.00005","13.3478","0.00007","9.56346","0.00005","90","","90","","90","","1231.23","0.011","650","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.05713","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001196","9.64236","0.00005","13.34917","0.00007","9.56139","0.00005","90","","90","","90","","1230.72","0.011","700","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.06006","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001197","9.63965","0.00005","13.35026","0.00007","9.55959","0.00005","90","","90","","90","","1230.24","0.011","750","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.06199","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001198","9.63696","0.00005","13.3511","0.00007","9.55783","0.00005","90","","90","","90","","1229.75","0.011","800","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.06332","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001199","9.6344","0.00005","13.35201","0.00007","9.55607","0.00005","90","","90","","90","","1229.28","0.011","850","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.06626","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001200","9.63194","0.00005","13.35293","0.00007","9.55447","0.00005","90","","90","","90","","1228.84","0.011","900","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.06851","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001201","9.6297","0.00005","13.35375","0.00007","9.55309","0.00005","90","","90","","90","","1228.46","0.011","950","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.06829","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001202","9.62547","0.00005","13.35545","0.00008","9.55038","0.00005","90","","90","","90","","1227.72","0.012","1050","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.07153","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001203","9.62355","0.00006","13.35626","0.00008","9.5491","0.00006","90","","90","","90","","1227.39","0.013","1100","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.07383","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001204","9.62166","0.00006","13.35709","0.00008","9.54792","0.00006","90","","90","","90","","1227.07","0.013","1150","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.07284","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001205","9.61988","0.00006","13.35768","0.00008","9.54671","0.00006","90","","90","","90","","1226.74","0.013","1200","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.07653","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001206","9.61797","0.00006","13.35797","0.00008","9.54552","0.00006","90","","90","","90","","1226.38","0.013","1250","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","","","","","","","","","","","","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001207","6.13228","0.00026","6.13228","","6.13228","","98.928","0.005","98.928","","98.928","","221.22","0.01","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","","","- O12 Sc6 W -","- O12 Sc6 W -","- O12 Sc6 W -","1","0.166667","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001208","9.61588","0.00006","13.35786","0.00009","9.54392","0.00006","90","","90","","90","","1225.89","0.014","1300","","","","","","","","","","","3","P n c a","-P 2a 2n","60","Scandium Tungstate","Scandium Tungstate","","- O12 Sc2 W3 -","- O12 Sc2 W3 -","- O48 Sc8 W12 -","4","0.5","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","","","","","","","","","","","","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001209","6.13563","0.0001","6.13563","","6.13563","","98.9226","0.0017","98.9226","","98.9226","","221.594","0.004","","","","","","","","","","","","3","R -3 :R","-P 3*","148","","","","- O12 Sc6 W -","- O12 Sc6 W -","- O12 Sc6 W -","1","0.166667","","Zhou, Yongkai; Adams, Stefan; Rao, R. Prasada; Edwards, Doreen D.; Neiman, Arkady; Pestereva, N.","Charge Transport by Polyatomic Anion Diffusion in Sc2(WO4)3","Chemistry of Materials","2008","20","20","6335","","10.1021/cm800466y","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001210","10.707","0.0005","13.5317","0.0005","16.9215","0.0006","68.1644","0.0013","85.9627","0.0012","84.4285","0.0012","2263.45","0.16","120","","120","","","","","","","","","3","P -1","-P 1","2","","","","- C57.5 H55.5 O3.5 -","- C57.5 H55.5 O3.5 -","- C115 H111 O7 -","2","1","","Feng, Xinliang; Pisula, Wojciech; Takase, Masayoshi; Dou, Xi; Enkelmann, Volker; Wagner, Manfred; Ding, Ning; Müllen, Klaus","Synthesis, Helical Organization, and Fibrous Formation ofC3Symmetric Methoxy-Substituted Discotic Hexa-peri-hexabenzocoronene","Chemistry of Materials","2008","20","9","2872","","10.1021/cm800515s","","","0.71073","MoKα","","0.1547","0.0557","","0.0314","0.0161","0.0161","","","","","","1.1562","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001211","13.7013","0.0019","18.271","0.002","22.817","0.003","84.145","0.009","83.761","0.009","83.781","0.009","5621.1","1.2","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H76 As3 F18 Li3 O18 -","- C36 H76 As3 F18 Li3 O18 -","- C144 H304 As12 F72 Li12 O72 -","4","2","","Zhang, Chuhong; Lilley, Scott J.; Ainsworth, David; Staunton, Edward; Andreev, Yuri G.; Slawin, Alexandra M. Z.; Bruce, Peter G.","Structure and Conductivity of Small-Molecule Electrolytes [CH3O(CH2CH2O)nCH3]:LiAsF6(n= 8−12)","Chemistry of Materials","2008","20","12","4039","","10.1021/cm8005327","","","0.71073","MoKα","","0.0514","0.0446","","","0.1126","0.118","","","","","","1.01","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001212","16.394","0.003","11.3514","0.0017","17.215","0.003","90","","108.251","0.005","90","","3042.5","0.9","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H38 As2 F12 Li2 O9 -","- C18 H38 As2 F12 Li2 O9 -","- C72 H152 As8 F48 Li8 O36 -","4","1","","Zhang, Chuhong; Lilley, Scott J.; Ainsworth, David; Staunton, Edward; Andreev, Yuri G.; Slawin, Alexandra M. Z.; Bruce, Peter G.","Structure and Conductivity of Small-Molecule Electrolytes [CH3O(CH2CH2O)nCH3]:LiAsF6(n= 8−12)","Chemistry of Materials","2008","20","12","4039","","10.1021/cm8005327","","","0.71073","MoKα","","0.059","0.0437","","","0.1035","0.1126","","","","","","1.055","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001213","9.2197","0.0014","9.3713","0.0014","35.083","0.006","82.412","0.011","84.302","0.012","87.731","0.01","2988.7","0.8","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H84 As3 F18 Li3 O20 -","- C40 H84 As3 F18 Li3 O20 -","- C80 H168 As6 F36 Li6 O40 -","2","1","","Zhang, Chuhong; Lilley, Scott J.; Ainsworth, David; Staunton, Edward; Andreev, Yuri G.; Slawin, Alexandra M. Z.; Bruce, Peter G.","Structure and Conductivity of Small-Molecule Electrolytes [CH3O(CH2CH2O)nCH3]:LiAsF6(n= 8−12)","Chemistry of Materials","2008","20","12","4039","","10.1021/cm8005327","","","0.71073","MoKα","","0.1823","0.1298","","","0.2635","0.2924","","","","","","1.116","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001214","9.399","0.003","9.498","0.003","11.832","0.004","104.518","0.015","111.092","0.013","91.857","0.017","945.2","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H50 As2 F12 Li2 O12 -","- C24 H50 As2 F12 Li2 O12 -","- C24 H50 As2 F12 Li2 O12 -","1","0.5","","Zhang, Chuhong; Lilley, Scott J.; Ainsworth, David; Staunton, Edward; Andreev, Yuri G.; Slawin, Alexandra M. Z.; Bruce, Peter G.","Structure and Conductivity of Small-Molecule Electrolytes [CH3O(CH2CH2O)nCH3]:LiAsF6(n= 8−12)","Chemistry of Materials","2008","20","12","4039","","10.1021/cm8005327","","","1.54178","CuKα","","0.1418","0.1379","","","0.3351","0.3439","","","","","","1.494","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001215","12.3091","0.0019","12.9354","0.0016","13.5584","0.0019","87.196","0.009","73.571","0.009","74.149","0.008","1991","0.5","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H54 As2 F12 Li2 O13 -","- C26 H54 As2 F12 Li2 O13 -","- C52 H108 As4 F24 Li4 O26 -","2","1","","Zhang, Chuhong; Lilley, Scott J.; Ainsworth, David; Staunton, Edward; Andreev, Yuri G.; Slawin, Alexandra M. Z.; Bruce, Peter G.","Structure and Conductivity of Small-Molecule Electrolytes [CH3O(CH2CH2O)nCH3]:LiAsF6(n= 8−12)","Chemistry of Materials","2008","20","12","4039","","10.1021/cm8005327","","","0.71073","MoKα","","0.1237","0.1069","","","0.2302","0.2409","","","","","","1.15","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001216","7.6335","0.0007","7.655","0.0008","16.8281","0.0008","75.65","0.009","86.542","0.013","81.391","0.008","941.65","0.14","125","","125","","","","","","","","","4","P -1","-P 1","2","","5,12-bis(triisopropylsilylethynyl)tetraceno[2,3-b]thiophene","","- C42 H52 S Si2 -","- C42.1108 H47.1808 S1.112 Si2 -","- C42.1108 H47.1808 S1.112 Si2 -","1","0.5","","Tang, Ming L.; Reichardt, Anna D.; Siegrist, Theo; Mannsfeld, Stefan C. B.; Bao, Zhenan","Trialkylsilylethynyl-Functionalized Tetraceno[2,3-b]thiophene and Anthra[2,3-b]thiophene Organic Transistors","Chemistry of Materials","2008","20","14","4669","","10.1021/cm800644y","","","0.71073","MoKα","","0.086","0.086","","0.2233","0.2233","0.2233","","","","","","1.0115","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001217","6.2831","0.0002","17.9804","0.0004","13.9958","0.0004","90","","90.225","0.003","90","","1581.13","0.08","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 S Si2 -","- C36 H40 S Si2 -","- C72 H80 S2 Si4 -","2","0.5","","Tang, Ming L.; Reichardt, Anna D.; Siegrist, Theo; Mannsfeld, Stefan C. B.; Bao, Zhenan","Trialkylsilylethynyl-Functionalized Tetraceno[2,3-b]thiophene and Anthra[2,3-b]thiophene Organic Transistors","Chemistry of Materials","2008","20","14","4669","","10.1021/cm800644y","","","0.71073","MoKα","","0.0726","0.0453","","0.1095","0.0969","0.1095","","","","","","1.2958","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001218","5.93","","10","","11.53","","75.43","","77.4","","84.7","","645.295","","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H26 S2 Si2 -","- C28.56 H26 S1.5 Si2 -","- C28.56 H26 S1.5 Si2 -","1","0.5","","Tang, Ming L.; Reichardt, Anna D.; Siegrist, Theo; Mannsfeld, Stefan C. B.; Bao, Zhenan","Trialkylsilylethynyl-Functionalized Tetraceno[2,3-b]thiophene and Anthra[2,3-b]thiophene Organic Transistors","Chemistry of Materials","2008","20","14","4669","","10.1021/cm800644y","","","0.71073","MoKα","","0.1345","0.0893","","0.217","0.2003","0.217","","","","","","1.2246","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001219","8.3354","0.0008","10.4582","0.001","11.0523","0.0015","68.223","0.011","86.768","0.009","85.011","0.008","891.01","0.18","120","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C38 H50 S Si2 -","- C37 S1.372 Si2 -","- C37 S1.372 Si2 -","1","0.5","","Tang, Ming L.; Reichardt, Anna D.; Siegrist, Theo; Mannsfeld, Stefan C. B.; Bao, Zhenan","Trialkylsilylethynyl-Functionalized Tetraceno[2,3-b]thiophene and Anthra[2,3-b]thiophene Organic Transistors","Chemistry of Materials","2008","20","14","4669","","10.1021/cm800644y","","","0.71073","MoKα","","0.1806","0.1132","","0.2489","0.2111","0.2489","","","","","","1.9614","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001220","11.0096","0.0008","11.3272","0.0008","11.9921","0.0012","90","","91.079","0.007","90","","1495.2","0.2","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H38 S Si2 -","- C31 S1.26 Si2 -","- C62 S2.52 Si4 -","2","1","","Tang, Ming L.; Reichardt, Anna D.; Siegrist, Theo; Mannsfeld, Stefan C. B.; Bao, Zhenan","Trialkylsilylethynyl-Functionalized Tetraceno[2,3-b]thiophene and Anthra[2,3-b]thiophene Organic Transistors","Chemistry of Materials","2008","20","14","4669","","10.1021/cm800644y","","","0.71073","MoKα","","0.2832","0.156","","0.3313","0.2539","0.3313","","","","","","1.3034","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001221","9.015","0.0005","9.4739","0.0006","19.7373","0.0011","88.964","0.001","78.938","0.001","85.489","0.001","1649.25","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H19 Al6 N4 O28 P7 -","- C10 H19 Al6 N4 O28 P7 -","- C20 H38 Al12 N8 O56 P14 -","2","1","","Xing, Hongzhu; Li, Jiyang; Yan, Wenfu; Chen, Peng; Jin, Zhao; Yu, Jihong; Dai, Sheng; Xu, Ruren","Cotemplating Ionothermal Synthesis of a New Open-Framework Aluminophosphate with Unique Al/P Ratio of 6/7","Chemistry of Materials","2008","20","13","4179","","10.1021/cm800701x","","","0.71073","MoKα","","0.0703","0.0572","","","0.1592","0.1736","","","","","","1.072","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001222","8.6408","0.0008","12.9692","0.0013","14.3498","0.0014","79.901","0.002","79.483","0.002","83.439","0.002","1551","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H48 N2 O2 -","- C38 H48 N2 O2 -","- C76 H96 N4 O4 -","2","1","","Beverina, Luca; Crippa, Maurizio; Salice, Patrizio; Ruffo, Riccardo; Ferrante, Camilla; Fortunati, Ilaria; Signorini, Raffaella; Mari, Claudio Maria; Bozio, Renato; Facchetti, Antonio; Pagani, Giorgio A.","Indolic Squaraines as Two-Photon Absorbing Dyes in the Visible Region: X-ray Structure, Electrochemical, and Nonlinear Optical Characterization","Chemistry of Materials","2008","20","10","3242","","10.1021/cm800714k","","","0.71073","MoKα","","0.0941","0.0516","","","0.1082","0.124","","","","","","0.9","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4001223","7.9237","0.0019","8.468","0.002","12.089","0.003","95.784","0.006","97.426","0.006","111.029","0.006","741.2","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H44 N2 O2 -","- C36 H44 N2 O2 -","- C36 H44 N2 O2 -","1","0.5","","Beverina, Luca; Crippa, Maurizio; Salice, Patrizio; Ruffo, Riccardo; Ferrante, Camilla; Fortunati, Ilaria; Signorini, Raffaella; Mari, Claudio Maria; Bozio, Renato; Facchetti, Antonio; Pagani, Giorgio A.","Indolic Squaraines as Two-Photon Absorbing Dyes in the Visible Region: X-ray Structure, Electrochemical, and Nonlinear Optical Characterization","Chemistry of Materials","2008","20","10","3242","","10.1021/cm800714k","","","0.71073","MoKα","","0.1162","0.087","","","0.2052","0.2167","","","","","","1.099","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4001224","11.943","0.005","22.59","0.008","6.805","0.002","90","","90","","90","","1835.9","1.1","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- Ga2 Ge Li S6 -","- Ga2 Ge Li2 S6 -","- Ga16 Ge8 Li16 S48 -","8","0.5","","Kim, Youngsik; Seo, In-seok; Martin, Steve W.; Baek, Jaewook; Shiv Halasyamani, P.; Arumugam, Nachiappan; Steinfink, Hugo","Characterization of New Infrared Nonlinear Optical Material with High Laser Damage Threshold, Li2Ga2GeS6","Chemistry of Materials","2008","20","19","6048","","10.1021/cm8007304","","","0.71073","MoKα","","0.0459","0.0459","","","0.113","0.113","","","","","","1.05","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001225","9.3965","0.0015","9.3965","0.0015","14.412","0.002","90","","90","","90","","1272.5","0.3","120","2","120","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","Bis(eta5-cyclopentadienyl)bis(methylselenolato)titanium(IV)","","- C12 H16 Se2 Ti -","- C12 H16 Se2 Ti -","- C48 H64 Se8 Ti4 -","4","0.5","","Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael","Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)","Chemistry of Materials","2008","20","15","5100","","10.1021/cm800802g","","","0.71073","MoKα","","0.0533","0.0423","","","0.0747","0.079","","","","","","1.144","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001226","9.5191","0.001","9.5191","0.001","14.604","0.002","90","","90","","90","","1323.3","0.3","120","2","120","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","Bis(eta5-cyclopentadienyl)bis(methylselenolato)hafnium(IV)","","- C12 H16 Hf Se2 -","- C12 H16 Hf Se2 -","- C48 H64 Hf4 Se8 -","4","0.5","","Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael","Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)","Chemistry of Materials","2008","20","15","5100","","10.1021/cm800802g","","","0.71073","MoKα","","0.0212","0.0204","","","0.0443","0.045","","","","","","1.115","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001227","8.2833","0.001","10.763","0.002","13.944","0.003","69.034","0.01","86.054","0.01","68.558","0.01","1077.8","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","mu-oxido-bis{bis(eta5-cyclopentadienyl)(methylselenolato)zirconium(IV)}","","- C22 H26 O Se2 Zr2 -","- C22 H26 O Se2 Zr2 -","- C44 H52 O2 Se4 Zr4 -","2","1","","Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael","Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)","Chemistry of Materials","2008","20","15","5100","","10.1021/cm800802g","","","0.71073","MoKα","","0.0352","0.0274","","","0.0662","0.0693","","","","","","1.011","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001228","16.434","0.004","9.3217","0.0017","12.668","0.002","90","","108.391","0.015","90","","1841.5","0.7","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","bis(eta5-cyclopentadienyl)bis(t-butylselenolato)titanium(IV)","","- C18 H28 Se2 Ti -","- C18 H28 Se2 Ti -","- C72 H112 Se8 Ti4 -","4","0.5","","Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael","Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)","Chemistry of Materials","2008","20","15","5100","","10.1021/cm800802g","","","0.71073","MoKα","","0.2528","0.086","","","0.178","0.2412","","","","","","1.004","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001229","10.026","0.002","10.026","0.002","19.288","0.003","90","","90","","90","","1938.8","0.6","120","2","120","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","bis(eta5-cyclopentadienyl)bis(t-butylselenolato)zirconium(IV)","","- C18 H28 Se2 Zr -","- C18 H28 Se2 Zr -","- C72 H112 Se8 Zr4 -","4","0.5","","Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael","Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)","Chemistry of Materials","2008","20","15","5100","","10.1021/cm800802g","","","0.71073","MoKα","","0.0979","0.0806","","","0.1755","0.1859","","","","","","1.035","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001230","5.6897","0.0001","13.6631","0.0003","16.5159","0.0004","90","","99.566","0.001","90","","1266.08","0.05","180","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","phen:1,4-tfbb 2/1","phenazine:1,4-dibromotetrafluorobenzene 2/1","","- C30 H16 Br2 F4 N2 -","- C30 H16 Br2 F4 N4 -","- C60 H32 Br4 F8 N8 -","2","0.5","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","Structural Equivalence of Br and I Halogen Bonds: A Route to Isostructural Materials with Controllable Properties","Chemistry of Materials","2008","20","21","6623","","10.1021/cm800923r","","","0.71073","MoKα","","0.0466","0.0364","","","0.1004","0.1203","","","","","","1.09","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001231","5.6639","0.0002","14.324","0.0004","16.573","0.0006","90","","102.224","0.001","90","","1314.08","0.08","180","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","phen:1,4-tfib 2/1","phenazine:tetrafluoro-1,4-dioodobenzene 2/1","","- C30 H16 F4 I2 N4 -","- C30 H16 F4 I2 N4 -","- C60 H32 F8 I4 N8 -","2","0.5","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","Structural Equivalence of Br and I Halogen Bonds: A Route to Isostructural Materials with Controllable Properties","Chemistry of Materials","2008","20","21","6623","","10.1021/cm800923r","","","0.71073","MoKα","","0.0601","0.0371","","","0.0922","0.1203","","","","","","1.139","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001232","9.9607","0.0002","5.6734","0.0001","23.0529","0.0003","90","","91.118","0.001","90","","1302.5","0.04","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,4-dibromo-tetrafluorobenzene-acridine 1/2","","- C32 H18 Br2 F4 N2 -","- C32 H18 Br2 F4 N2 -","- C64 H36 Br4 F8 N4 -","2","0.5","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","Structural Equivalence of Br and I Halogen Bonds: A Route to Isostructural Materials with Controllable Properties","Chemistry of Materials","2008","20","21","6623","","10.1021/cm800923r","","","0.71073","MoKα","","0.0688","0.0433","","","0.1261","0.161","","","","","","1.206","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001233","10.4907","0.0002","5.5679","0.0001","23.0787","0.0004","90","","90.765","0.001","90","","1347.93","0.04","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","acr-tfib 2/1","acridine-tetrafluoro-1,4-dioodobenzene 2/1","","- C32 H18 F4 I2 N2 -","- C32 H18 F4 I2 N2 -","- C64 H36 F8 I4 N4 -","2","0.5","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","Structural Equivalence of Br and I Halogen Bonds: A Route to Isostructural Materials with Controllable Properties","Chemistry of Materials","2008","20","21","6623","","10.1021/cm800923r","","","0.71073","MoKα","","0.0514","0.0346","","","0.096","0.1249","","","","","","1.214","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001234","6.2077","0.0002","9.5818","0.0004","12.7244","0.0005","104.361","0.003","97.004","0.002","107.591","0.002","682.85","0.05","180","2","293","2","","","","","","","","4","P -1","-P 1","2","DABCO:1,4-dib 1/1","1,4-diazabicyclo[2.2.2]octane:1,4-diiodobenzene 1/1","","- C12 H14 I2 N2 -","- C12 H16 I2 N2 -","- C24 H32 I4 N4 -","2","1","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","Structural Equivalence of Br and I Halogen Bonds: A Route to Isostructural Materials with Controllable Properties","Chemistry of Materials","2008","20","21","6623","","10.1021/cm800923r","","","0.71073","MoKα","","0.0739","0.0509","","","0.1255","0.1418","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4001235","7.6325","","16.5001","","6.9985","","90","","119.501","","90","","767.098","","","","823","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- O4.5 Pb V1.5 -","- O2.25 Pb0.5 V0.75 -","- O36 Pb8 V12 -","16","4","","Mentré, O.; Koo, H.-J.; Whangbo, M.-H.","Investigation of the Vanadyl Bond Ordering and Analysis of the Spin Exchange Interactions in Pb2V3O9and Pb2As2VO9","Chemistry of Materials","2008","20","22","6929","","10.1021/cm800924j","","","0.71073","MoKα","","0.0602","0.0501","","","0.0576","0.0659","","","","0.86","0.86","0.89","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001236","7.6002","","16.411","","6.9815","","91.336","","119.324","","90.517","","758.787","","","","293","","","","","","","","","3","C 1","C 1","1","","","","- O9 Pb2 V3 -","- O9 Pb2 V3 -","- O36 Pb8 V12 -","4","","","Mentré, O.; Koo, H.-J.; Whangbo, M.-H.","Investigation of the Vanadyl Bond Ordering and Analysis of the Spin Exchange Interactions in Pb2V3O9and Pb2As2VO9","Chemistry of Materials","2008","20","22","6929","","10.1021/cm800924j","","","0.71069","MoKα","","0.0798","0.0449","","","0.0499","0.0516","","","","2.35","2.35","1.94","","","","has coordinates","209123","2020-10-21","18:00:00",""
"4001237","7.5647","0.0017","16.473","0.004","6.9557","0.0016","90","","120.07","0.004","90","","750.1","0.3","","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- As2 O9 Pb2 V -","- As2 O9 Pb2 V -","- As8 O36 Pb8 V4 -","4","1","","Mentré, O.; Koo, H.-J.; Whangbo, M.-H.","Investigation of the Vanadyl Bond Ordering and Analysis of the Spin Exchange Interactions in Pb2V3O9and Pb2As2VO9","Chemistry of Materials","2008","20","22","6929","","10.1021/cm800924j","","","0.71073","MoKα","","0.0583","0.0442","","","0.0443","0.0551","","","","2.98","2.98","3.15","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001238","6.427","0.006","11.786","0.015","10.615","0.013","90","","91.47","0.1","90","","803.8","1.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H7 Ba O8 P -","- C2 H7 Ba O8 P -","- C8 H28 Ba4 O32 P4 -","4","1","","Demadis, Konstantinos D.; Papadaki, Maria; Raptis, Raphael G.; Zhao, Hong","Corrugated, Sheet-Like Architectures in Layered Alkaline-Earth MetalR,S-Hydroxyphosphonoacetate Frameworks: Applications for Anticorrosion Protection of Metal Surfaces","Chemistry of Materials","2008","20","15","4835","","10.1021/cm801004w","","","0.71073","MoKα","","0.029","0.0285","","","0.0747","0.0751","","","","","","1.166","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001239","11.381","0.003","6.9693","0.0017","13.271","0.003","90","","112.404","0.018","90","","973.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H11 O10 P Sr -","- C2 H11 O10 P Sr -","- C8 H44 O40 P4 Sr4 -","4","1","","Demadis, Konstantinos D.; Papadaki, Maria; Raptis, Raphael G.; Zhao, Hong","Corrugated, Sheet-Like Architectures in Layered Alkaline-Earth MetalR,S-Hydroxyphosphonoacetate Frameworks: Applications for Anticorrosion Protection of Metal Surfaces","Chemistry of Materials","2008","20","15","4835","","10.1021/cm801004w","","","0.71073","MoKα","","0.0264","0.0242","","","0.0655","0.0666","","","","","","1.078","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001240","6.279","0.002","11.203","0.006","10.443","0.005","90","","92.02","0.04","90","","734.1","0.6","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H7 O8 P Sr -","- C2 H7 O8 P Sr -","- C8 H28 O32 P4 Sr4 -","4","1","","Demadis, Konstantinos D.; Papadaki, Maria; Raptis, Raphael G.; Zhao, Hong","Corrugated, Sheet-Like Architectures in Layered Alkaline-Earth MetalR,S-Hydroxyphosphonoacetate Frameworks: Applications for Anticorrosion Protection of Metal Surfaces","Chemistry of Materials","2008","20","15","4835","","10.1021/cm801004w","","","0.71073","MoKα","","0.0239","0.0229","","","0.0614","0.0618","","","","","","1.081","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001241","9.81605","0.00014","9.81605","","2.85489","0.00005","90","","90","","90","","275.082","0.006","","","","","","","","","","","","4","I 4/m","-I 4","87","","","","- K0.07 Mn0.5 O W0 -","- K0.0663775 Mn0.495965 O W0.004035 -","- K1.06204 Mn7.93544 O16 W0.06456 -","16","1","","Calvert, Craig; Joesten, Raymond; Ngala, Katana; Villegas, Josanlet; Morey, Aimee; Shen, Xiongfei; Suib, Steven L.","Synthesis, Characterization, and Rietveld Refinement of Tungsten-Framework-Doped Porous Manganese Oxide (K-OMS-2) Material","Chemistry of Materials","2008","20","20","6382","","10.1021/cm801146m","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","0.06145","","2.08","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001242","9.80411","0.00015","9.80411","","2.85201","0.00005","90","","90","","90","","274.137","0.006","","","","","","","","","","","","1","I 4/m","-I 4","87","","","","- K0.06 -","- K0.0636775 Mn0.493625 O W0.006375 -","- K1.01884 Mn7.898 O16 W0.102 -","16","1","","Calvert, Craig; Joesten, Raymond; Ngala, Katana; Villegas, Josanlet; Morey, Aimee; Shen, Xiongfei; Suib, Steven L.","Synthesis, Characterization, and Rietveld Refinement of Tungsten-Framework-Doped Porous Manganese Oxide (K-OMS-2) Material","Chemistry of Materials","2008","20","20","6382","","10.1021/cm801146m","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","0.06417","","1.85","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001243","5.87589","0.00018","8.42064","0.00011","17.6455","0.0005","90","","90","","90","","873.08","0.04","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Li3.06 Mg1.94 O6 Ru -","- Li3.059 Mg1.941 O6 Ru -","- Li24.472 Mg15.528 O48 Ru8 -","8","0.25","","Derakhshan, Shahab; Greedan, John E.; Katsumata, Tetsuhiro; Cranswick, Lachlan M. D.","Long-Range Antiferromagnetic Ordering in the Novel Magnetically Frustrated Rock Salt Oxide System: Li3Mg2RuO6","Chemistry of Materials","2008","20","17","5714","","10.1021/cm801161r","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001244","20.638","0.002","6.5041","0.0007","13.4368","0.0015","90","","94.15","0.002","90","","1798.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 Co K O5 -","- C8 H5 Co K O5 -","- C64 H40 Co8 K8 O40 -","8","1","","Cheng, Xiao-Ning; Xue, Wei; Zhang, Wei-Xiong; Chen, Xiao-Ming","Weak Ferromagnetism and Dynamic Magnetic Behavior of Two 2D Compounds with Hydroxy/Carboxylate-Bridged Co(II) Chains","Chemistry of Materials","2008","20","16","5345","","10.1021/cm8012599","","","0.71073","MoKα","","0.0324","0.0303","","","0.0772","0.0789","","","","","","1.038","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001245","20.68","0.005","6.6343","0.0016","13.909","0.004","90","","92.946","0.004","90","","1905.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 Co Cs O5 -","- C8 H5 Co Cs O5 -","- C64 H40 Co8 Cs8 O40 -","8","1","","Cheng, Xiao-Ning; Xue, Wei; Zhang, Wei-Xiong; Chen, Xiao-Ming","Weak Ferromagnetism and Dynamic Magnetic Behavior of Two 2D Compounds with Hydroxy/Carboxylate-Bridged Co(II) Chains","Chemistry of Materials","2008","20","16","5345","","10.1021/cm8012599","","","0.71073","MoKα","","0.0635","0.0576","","","0.1363","0.1394","","","","","","1.135","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001246","6.2126","0.0012","28.296","0.006","7.5789","0.0015","90","","90.53","0.03","90","","1332.3","0.5","113","2","113","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H12 S -","- C20 H12 S -","- C80 H48 S4 -","4","2","","Du, Chunyan; Guo, Yunlong; Liu, Yunqi; Qiu, Wenfeng; Zhang, Hengjun; Gao, Xike; Liu, Ying; Qi, Ting; Lu, Kun; Yu, Gui","Anthra[2,3-b]benzo[d]thiophene: An Air-Stable Asymmetric Organic Semiconductor with High Mobility at Room Temperature","Chemistry of Materials","2008","20","13","4188","","10.1021/cm801305f","","","0.71073","MoKα","","0.0431","0.0386","","","0.0819","0.0851","","","","","","1.025","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001249","6.419","0.002","8.081","0.003","6.116","0.002","102.1","0.02","95.89","0.02","106.87","0.03","292.29","0.18","293.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H12 S4 -","- C10 H12 S4 -","- C10 H12 S4 -","1","0.5","","Bando, Yoshimasa; Shirahata, Takashi; Shibata, Koji; Wada, Hiroshi; Mori, Takehiko; Imakubo, Tatsuro","Organic Field-Effect Transistors Based on Alkyl-Terminated Tetrathiapentalene (TTP) Derivatives","Chemistry of Materials","2008","20","16","5119","","10.1021/cm801404d","","","0.7107","MoKa","","","0.0435","","","","0.1466","","","","","","1.933","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001250","10.608","0.007","13.666","0.006","5.216","0.002","96.14","0.03","90","0.04","72.13","0.04","715.1","0.7","293.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C14 H16 S4 -","- C14 H16 S4 -","- C28 H32 S8 -","2","1","","Bando, Yoshimasa; Shirahata, Takashi; Shibata, Koji; Wada, Hiroshi; Mori, Takehiko; Imakubo, Tatsuro","Organic Field-Effect Transistors Based on Alkyl-Terminated Tetrathiapentalene (TTP) Derivatives","Chemistry of Materials","2008","20","16","5119","","10.1021/cm801404d","","","0.7107","MoKa","","","0.0473","","","","0.1336","","","","","","1.371","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001251","6.6429","0.0013","10.541","0.002","16.573","0.003","83.88","0.03","86.2","0.03","84.05","0.03","1145.9","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C60 H42 N4 -","- C60 H42 N4 -","- C60 H42 N4 -","1","0.5","","Li, Yupeng; Shen, Fangzhong; Wang, Huan; He, Feng; Xie, Zengqi; Zhang, Houyu; Wang, Zhiming; Liu, Linlin; Li, Feng; Hanif, Muddasir; Ye, Ling; Ma, Yuguang","Supramolecular Network Conducting the Formation of Uniaxially Oriented Molecular Crystal of Cyano Substituted Oligo(p-phenylene vinylene) and Its Amplified Spontaneous Emission (ASE) Behavior","Chemistry of Materials","2008","20","23","7312","","10.1021/cm801427s","","","0.71073","MoKα","","0.139","0.0644","","","0.1208","0.1505","","","","","","1.018","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001252","17.257","0.003","4.1599","0.0006","17.49","0.003","90","","90","","90","","1255.6","0.4","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba2 In5 P5 -","- Ba2 In5 P5 -","- Ba8 In20 P20 -","4","0.5","","Mathieu, Josiah; Achey, Randall; Park, Ju-Hyun; Purcell, Kenneth M.; Tozer, Stanley W.; Latturner, Susan E.","Flux Growth and Electronic Properties of Ba2In5Pn5(Pn = P, As): Zintl Phases Exhibiting Metallic Behavior","Chemistry of Materials","2008","20","17","5675","","10.1021/cm8015353","","","0.71073","MoKα","","0.0464","0.0376","","","0.069","0.0718","","","","","","1.196","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001253","17.4609","0.0015","4.2905","0.0004","17.9614","0.0015","90","","90","","90","","1345.6","0.2","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- As5 Ba2 In5 -","- As5 Ba2 In5 -","- As20 Ba8 In20 -","4","0.5","","Mathieu, Josiah; Achey, Randall; Park, Ju-Hyun; Purcell, Kenneth M.; Tozer, Stanley W.; Latturner, Susan E.","Flux Growth and Electronic Properties of Ba2In5Pn5(Pn = P, As): Zintl Phases Exhibiting Metallic Behavior","Chemistry of Materials","2008","20","17","5675","","10.1021/cm8015353","","","0.71073","MoKα","","0.0404","0.039","","","0.0844","0.085","","","","","","1.347","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001254","8.7184","0.0011","8.7184","0.0011","15.171","0.003","90","","90","","90","","1153.2","0.3","298","","298","","","","","","","","","4","P 42/n m c :2","-P 4ac 2a","137","tbfe4al9si6","","","- Al9 Fe4 Si6 Tb -","- Al9 Fe4 Si6 Tb -","- Al36 Fe16 Si24 Tb4 -","4","0.25","","Sieve, Bradley; Gray, Danielle L.; Henning, Robert; Bakas, Thomas; Schultz, Arthur J.; Kanatzidis, Mercouri G.","Al Flux Synthesis of the Oxidation-Resistant Quaternary Phase REFe4Al9Si6(RE = Tb, Er)","Chemistry of Materials","2008","20","19","6107","","10.1021/cm801554d","","","0.71073","MoKα","","0.0219","0.0202","","","0.0505","0.051","","","","","","1.273","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001255","8.7184","0.0011","8.7184","0.0011","15.171","0.003","90","","90","","90","","1153.2","0.3","298","","298","","","","","","","","","4","P 42/n m c :2","-P 4ac 2a","137","tbfe4al9si6","","","- Al9 Fe4 Si6 Tb -","- Al9 Fe4 Si6 Tb -","- Al36 Fe16 Si24 Tb4 -","4","0.25","","Sieve, Bradley; Gray, Danielle L.; Henning, Robert; Bakas, Thomas; Schultz, Arthur J.; Kanatzidis, Mercouri G.","Al Flux Synthesis of the Oxidation-Resistant Quaternary Phase REFe4Al9Si6(RE = Tb, Er)","Chemistry of Materials","2008","20","19","6107","","10.1021/cm801554d","","neutron","","neutron","","0.0493","0.0401","","","0.0915","0.0959","","","","","","1.046","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001256","8.6882","0.0012","8.6882","0.0012","15.115","0.003","90","","90","","90","","1141","0.3","298","","298","","","","","","","","","4","P 42/n m c :2","-P 4ac 2a","137","ErFe4Al9Si6","","","- Al9 Er Fe4 Si6 -","- Al9 Er Fe4 Si6 -","- Al36 Er4 Fe16 Si24 -","4","0.25","","Sieve, Bradley; Gray, Danielle L.; Henning, Robert; Bakas, Thomas; Schultz, Arthur J.; Kanatzidis, Mercouri G.","Al Flux Synthesis of the Oxidation-Resistant Quaternary Phase REFe4Al9Si6(RE = Tb, Er)","Chemistry of Materials","2008","20","19","6107","","10.1021/cm801554d","","","0.71073","MoKα","","0.0256","0.0255","","","0.0656","0.0657","","","","","","1.351","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001257","14.501","0.003","15.714","0.003","18.541","0.004","90","","111.17","0.03","90","","3939.8","1.6","150","2","150","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C32 H66 O8 Pt Si2 -","- C32 H66 O8 Pt Si2 -","- C128 H264 O32 Pt4 Si8 -","4","1","","Ruddy, Daniel A.; Jarupatrakorn, Jonggol; Rioux, Robert M.; Miller, Jeffrey T.; McMurdo, Meredith J.; McBee, Jennifer L.; Tupper, Karl A.; Tilley, T. Don","Site-Isolated Pt-SBA15 Materials from Tris(tert-butoxy)siloxy Complexes of Pt(II) and Pt(IV)","Chemistry of Materials","2008","20","20","6517","","10.1021/cm801598k","","","0.71073","MoKα","","0.0439","0.0343","","","0.0659","0.0679","","","","","","0.998","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001258","11.299","0.003","15.75","0.004","15.849","0.004","90","","95.882","0.004","90","","2805.6","1.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H52 N2 O4 Pt Si -","- C21 H52 N2 O4 Pt Si -","- C84 H208 N8 O16 Pt4 Si4 -","4","1","","Ruddy, Daniel A.; Jarupatrakorn, Jonggol; Rioux, Robert M.; Miller, Jeffrey T.; McMurdo, Meredith J.; McBee, Jennifer L.; Tupper, Karl A.; Tilley, T. Don","Site-Isolated Pt-SBA15 Materials from Tris(tert-butoxy)siloxy Complexes of Pt(II) and Pt(IV)","Chemistry of Materials","2008","20","20","6517","","10.1021/cm801598k","","","0.71073","MoKα","","0.102","0.0514","","","0.1047","0.1283","","","","","","0.981","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001259","7.625","0.001","7.5488","0.0009","6.8453","0.0009","90","","112.029","0.013","90","","365.25","0.09","20","2","20","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","Copper(II) fluoride pyrazine hydrate","","","- C4 H8 Cu F2 N2 O2 -","- C4 H8 Cu F2 N2 O2 -","- C8 H16 Cu2 F4 N4 O4 -","2","0.5","","Manson, Jamie L.; Conner, Marianne M.; Schlueter, John A.; McConnell, Amber C.; Southerland, Heather I.; Malfant, Isabelle; Lancaster, Tom; Blundell, Stephen J.; Brooks, Michael L.; Pratt, Francis L.; Singleton, John; McDonald, Ross D.; Lee, Changhoon; Whangbo, Myung-Hwan","Experimental and Theoretical Characterization of the Magnetic Properties of CuF2(H2O)2(pyz) (pyz = pyrazine): A Two-Dimensional Quantum Magnet Arising from Supersuperexchange Interactions through Hydrogen Bonded Paths","Chemistry of Materials","2008","20","24","7408","","10.1021/cm8016566","","","0.71073","MoKα","","0.0265","0.0256","","","0.0712","0.0721","","","","","","1.188","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001260","7.6617","0.0012","7.5402","0.0013","6.8674","0.0011","90","","111.966","0.006","90","","367.93","0.11","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Copper(II) fluoride pyrazine hydrate","","","- C4 H8 Cu F2 N2 O2 -","- C4 H8 Cu F2 N2 O2 -","- C8 H16 Cu2 F4 N4 O4 -","2","0.5","","Manson, Jamie L.; Conner, Marianne M.; Schlueter, John A.; McConnell, Amber C.; Southerland, Heather I.; Malfant, Isabelle; Lancaster, Tom; Blundell, Stephen J.; Brooks, Michael L.; Pratt, Francis L.; Singleton, John; McDonald, Ross D.; Lee, Changhoon; Whangbo, Myung-Hwan","Experimental and Theoretical Characterization of the Magnetic Properties of CuF2(H2O)2(pyz) (pyz = pyrazine): A Two-Dimensional Quantum Magnet Arising from Supersuperexchange Interactions through Hydrogen Bonded Paths","Chemistry of Materials","2008","20","24","7408","","10.1021/cm8016566","","","0.71073","MoKα","","0.0239","0.0234","","","0.0831","0.0838","","","","","","1.219","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001261","7.6926","0.0006","7.5568","0.0006","6.897","0.0005","90","","111.065","0.003","90","","374.14","0.05","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Copper(II) fluoride pyrazine hydrate","","","- C4 H8 Cu F2 N2 O2 -","- C4 H8 Cu F2 N2 O2 -","- C8 H16 Cu2 F4 N4 O4 -","2","0.5","","Manson, Jamie L.; Conner, Marianne M.; Schlueter, John A.; McConnell, Amber C.; Southerland, Heather I.; Malfant, Isabelle; Lancaster, Tom; Blundell, Stephen J.; Brooks, Michael L.; Pratt, Francis L.; Singleton, John; McDonald, Ross D.; Lee, Changhoon; Whangbo, Myung-Hwan","Experimental and Theoretical Characterization of the Magnetic Properties of CuF2(H2O)2(pyz) (pyz = pyrazine): A Two-Dimensional Quantum Magnet Arising from Supersuperexchange Interactions through Hydrogen Bonded Paths","Chemistry of Materials","2008","20","24","7408","","10.1021/cm8016566","","","0.71073","MoKα","","0.0169","0.0159","","","0.0511","0.0519","","","","","","1.109","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001262","6.073","0.003","6.073","0.003","15.547","0.005","90","","90","","90","","573.4","0.4","298","2","298","2","","","","","","","","3","P 4/n b m :2","-P 4a 2b","125","","","","- Ga12 La2 Ni -","- Ga12 La2 Ni -","- Ga24 La4 Ni2 -","2","0.125","","Cho, Jung Young; Millican, Jasmine N.; Capan, Cigdem; Sokolov, Dmitry A.; Moldovan, Monica; Karki, Amar B.; Young, David P.; Aronson, Meigan C.; Chan, Julia Y.","Crystal Growth, Structure, and Physical Properties ofLn2MGa12(Ln= La, Ce;M= Ni, Cu)","Chemistry of Materials","2008","20","19","6116","","10.1021/cm801693t","","","0.71073","MoKα","","0.0337","0.0272","","","0.0632","0.0662","","","","","","1.067","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001263","6.036","0.002","6.036","0.002","15.506","0.008","90","","90","","90","","564.9","0.4","298","2","298","2","","","","","","","","3","P 4/n b m :2","-P 4a 2b","125","","","","- Ce2 Ga12 Ni -","- Ce2 Ga12 Ni -","- Ce4 Ga24 Ni2 -","2","0.125","","Cho, Jung Young; Millican, Jasmine N.; Capan, Cigdem; Sokolov, Dmitry A.; Moldovan, Monica; Karki, Amar B.; Young, David P.; Aronson, Meigan C.; Chan, Julia Y.","Crystal Growth, Structure, and Physical Properties ofLn2MGa12(Ln= La, Ce;M= Ni, Cu)","Chemistry of Materials","2008","20","19","6116","","10.1021/cm801693t","","","0.71073","MoKα","","0.0403","0.0298","","","0.0624","0.0664","","","","","","1.104","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001264","6.108","0.003","6.108","0.003","15.375","0.004","90","","90","","90","","573.6","0.4","298","2","298","2","","","","","","","","3","P 4/n b m :2","-P 4a 2b","125","","","","- Ce2 Cu Ga12 -","- Ce2 Cu Ga12 -","- Ce4 Cu2 Ga24 -","2","0.125","","Cho, Jung Young; Millican, Jasmine N.; Capan, Cigdem; Sokolov, Dmitry A.; Moldovan, Monica; Karki, Amar B.; Young, David P.; Aronson, Meigan C.; Chan, Julia Y.","Crystal Growth, Structure, and Physical Properties ofLn2MGa12(Ln= La, Ce;M= Ni, Cu)","Chemistry of Materials","2008","20","19","6116","","10.1021/cm801693t","","","0.71073","MoKα","","0.0611","0.0558","","","0.1444","0.1503","","","","","","1.177","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001265","6.09","0.002","6.09","0.002","15.348","0.007","90","","90","","90","","569.2","0.4","90","2","90","2","","","","","","","","3","P 4/n b m :2","-P 4a 2b","125","","","","- Ce2 Cu Ga12 -","- Ce2 Cu Ga12 -","- Ce4 Cu2 Ga24 -","2","0.125","","Cho, Jung Young; Millican, Jasmine N.; Capan, Cigdem; Sokolov, Dmitry A.; Moldovan, Monica; Karki, Amar B.; Young, David P.; Aronson, Meigan C.; Chan, Julia Y.","Crystal Growth, Structure, and Physical Properties ofLn2MGa12(Ln= La, Ce;M= Ni, Cu)","Chemistry of Materials","2008","20","19","6116","","10.1021/cm801693t","","","0.71073","MoKα","","0.0567","0.0433","","","0.1045","0.1114","","","","","","1.093","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001266","15.951","0.001","15.951","0.001","12.006","0.001","90","","90","","90","","3054.7","0.4","150","0.1","150","0.1","","","","","","","","5","I -4 2 m","I -4 2","121","","","","- C60 H68 Cu4 I4 P4 -","- C54 H64 Cu4 I4 P4 -","- C108 H128 Cu8 I8 P8 -","2","0.125","","Tard, Cédric; Perruchas, Sandrine; Maron, Sébastien; Le Goff, Xavier F.; Guillen, François; Garcia, Alain; Vigneron, Jacky; Etcheberry, Arnaud; Gacoin, Thierry; Boilot, Jean-Pierre","Thermochromic Luminescence of Sol−Gel Films Based on Copper Iodide Clusters","Chemistry of Materials","2008","20","22","7010","","10.1021/cm801780g","","","0.71069","MoKα","","0.0861","0.0731","","","0.1953","0.2144","","","","","","1.118","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001267","10.32421","0.00013","6.00449","0.00007","4.6983","0.00006","90","","90","","90","","291.255","0.006","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Fe0.99 Li0.9 O4 P Zr0.03 -","- Fe0.987 Li0.8953 O4 P Zr0.0316 -","- Fe3.948 Li3.5812 O16 P4 Zr0.1264 -","4","0.5","","Wagemaker, Marnix; Ellis, Brian L.; Lützenkirchen-Hecht, Dirk; Mulder, Fokko M.; Nazar, Linda F.","Proof of Supervalent Doping in Olivine LiFePO4","Chemistry of Materials","2008","20","20","6313","","10.1021/cm801781k","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001268","9.81363","","5.81776","","4.78301","","90","","90","","90","","273.078","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Fe1.08 O4 P -","- Fe1.08312 O4 P -","- Fe4.33248 O16 P4 -","4","0.5","","Wagemaker, Marnix; Ellis, Brian L.; Lützenkirchen-Hecht, Dirk; Mulder, Fokko M.; Nazar, Linda F.","Proof of Supervalent Doping in Olivine LiFePO4","Chemistry of Materials","2008","20","20","6313","","10.1021/cm801781k","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001269","10.31181","0.00016","5.99753","0.0001","4.69673","0.00007","90","","90","","90","","290.471","0.008","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Fe0.99 Li0.97 O4 P Zr0.01 -","- Fe0.993 Li0.973 O4 P Zr0.0085 -","- Fe3.972 Li3.892 O16 P4 Zr0.034 -","4","0.5","","Wagemaker, Marnix; Ellis, Brian L.; Lützenkirchen-Hecht, Dirk; Mulder, Fokko M.; Nazar, Linda F.","Proof of Supervalent Doping in Olivine LiFePO4","Chemistry of Materials","2008","20","20","6313","","10.1021/cm801781k","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001270","9.3243","0.0018","11.391","0.002","8.4009","0.0016","90","","90","","90","","892.3","0.3","150","2","150","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C4 H14 F5 In N2 -","- C4 H14 F5 In N2 -","- C16 H56 F20 In4 N8 -","4","0.25","","Jayasundera, Anil C. A.; Finch, Adrian A.; Wormald, Philip; Lightfoot, Philip","Solvothermal Synthesis and Luminescent Properties of Two Organically Templated Chain-Structure Fluorides, [C4H14N2][MF5] (M = In, Sc)","Chemistry of Materials","2008","20","21","6810","","10.1021/cm802049d","","","0.7749","synchrotron","","0.0271","0.0254","","","0.0677","0.0702","","","","","","0.965","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001271","9.353","0.003","11.433","0.001","8.226","0.004","90","","90","","90","","879.6","0.5","93","2","93","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C4 H14 F5 N2 Sc -","- C4 H14 F5 N2 Sc -","- C16 H56 F20 N8 Sc4 -","4","0.25","","Jayasundera, Anil C. A.; Finch, Adrian A.; Wormald, Philip; Lightfoot, Philip","Solvothermal Synthesis and Luminescent Properties of Two Organically Templated Chain-Structure Fluorides, [C4H14N2][MF5] (M = In, Sc)","Chemistry of Materials","2008","20","21","6810","","10.1021/cm802049d","","","0.71073","MoKα","","0.0571","0.0415","","","0.1173","0.1656","","","","","","1.906","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001272","12.5108","0.001","8.393","0.0013","7.0438","0.001","90","","90","","90","","739.62","0.17","120","2","120","2","","","","","","","","3","P c a 21","P 2c -2ac","29","8.4 Angstrom phase","","","- Cl2 O13 Yb4 -","- Cl2 O13 Yb4 -","- Cl4 O26 Yb8 -","2","0.5","","Poudret, Leslie; Prior, Timothy J.; McIntyre, Laura J.; Fogg, Andrew M.","Synthesis and Crystal Structures of New Lanthanide Hydroxyhalide Anion Exchange Materials, Ln2(OH)5X·1.5H2O (X = Cl, Br; Ln = Y, Dy, Er, Yb)","Chemistry of Materials","2008","20","24","7447","","10.1021/cm802301a","","","0.6943","synchrotron","","0.041","0.033","","","0.0685","0.0733","","","","","","1.178","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001273","6.9438","0.0009","8.2773","0.001","19.208","0.002","79.69","0.002","80.961","0.002","68.408","0.002","1004.9","0.2","209","2","209","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H19 N3 O2 -","- C25 H19 N3 O2 -","- C50 H38 N6 O4 -","2","1","","Xiong, Ying; Tang, Hongding; Zhang, Jidong; Wang, Zhi Yuan; Campo, Jochen; Wenseleers, Wim; Goovaerts, Etienne","Functionalized Picolinium Quinodimethane Chromophores for Electro-Optics: Synthesis, Aggregation Behavior, and Nonlinear Optical Properties","Chemistry of Materials","2008","20","24","7465","","10.1021/cm802341j","","","0.71073","MoKα","","0.1045","0.0591","","","0.1222","0.1387","","","","","","0.975","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001274","17.6356","0.0005","48.0644","0.0013","24.5539","0.0007","90","","90","","90","","20813","1","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","TIF-2","TIF-2","","- C10.46 H15 N4 Zn -","- C10.6317 N4 Zn -","- C510.32 N192 Zn48 -","48","6","","Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun","New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands","Chemistry of Materials","2008","20","24","7377","","10.1021/cm802400f","","","0.71073","MoKα","","0.14","0.0955","","","0.2511","0.2742","","","","","","1.077","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001275","25.9164","0.001","24.8826","0.001","17.9542","0.0006","90","","93.206","0.003","90","","11560","0.8","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","TIF-3","TIF-3","","- C9.13 H0 N4 Zn -","- C9.125 N4 Zn -","- C292 N128 Zn32 -","32","4","","Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun","New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands","Chemistry of Materials","2008","20","24","7377","","10.1021/cm802400f","","","0.71073","MoKα","","0.1988","0.127","","","0.3227","0.3615","","","","","","1.019","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001276","15.6251","0.0009","16.3217","0.0009","18.1244","0.001","90","","90","","90","","4622.2","0.4","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","TIF-4","TIF-4","","- C11.5 H11 N4 Zn -","- C11.5 H11 N4 Zn -","- C184 H176 N64 Zn16 -","16","2","","Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun","New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands","Chemistry of Materials","2008","20","24","7377","","10.1021/cm802400f","","","0.71073","MoKα","","0.0882","0.0709","","","0.2216","0.2448","","","","","","1.091","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001277","16.7862","0.0002","16.7862","0.0002","21.3384","0.0005","90","","90","","90","","6012.66","0.17","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","TIF-5Zn","TIF-5Zn","","- C12 H18 N4 O3 Zn -","- C12 H12 N4 O0.99 Zn -","- C192 H192 N64 O15.84 Zn16 -","16","1","","Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun","New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands","Chemistry of Materials","2008","20","24","7377","","10.1021/cm802400f","","","0.71073","MoKα","","0.1254","0.0938","","","0.2741","0.2959","","","","","","1.175","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001278","16.6286","0.0002","16.6286","0.0002","21.4148","0.0004","90","","90","","90","","5921.41","0.15","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","TIF-5Co","TIF-5Co","","- C12 H18 Co N4 O3 -","- C12 H12 Co N4 O -","- C192 H192 Co16 N64 O16 -","16","1","","Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun","New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands","Chemistry of Materials","2008","20","24","7377","","10.1021/cm802400f","","","0.71073","MoKα","","0.0896","0.0652","","","0.1927","0.2156","","","","","","1.077","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001279","17.4113","0.0014","25.125","0.0017","19.4361","0.0017","90","","108.493","0.004","90","","8063.4","1.1","123.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C99 H72 Cl2 N6 O2 S2 -","- C99 H72 Cl2 N6 O2 S2 -","- C396 H288 Cl8 N24 O8 S8 -","4","0.5","","Nakanishi, Tatsuaki; Kojima, Takahiko; Ohkubo, Kei; Hasobe, Taku; Nakayama, Ken-ichi; Fukuzumi, Shunichi","Photoconductivity of Porphyrin Nanochannels Composed of Diprotonated Porphyrin Dications with Saddle Distortion and Electron Donors","Chemistry of Materials","2008","20","24","7492","","10.1021/cm802460t","","","0.7107","MoKα","","","0.0904","","","","0.2218","","","","","","1.29","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4003426","5.1126","0.0001","6.3189","0.0002","12.0396","0.0005","100.931","0.002","97.211","0.002","90.683","0.003","378.62","0.02","298","2","298","2","","","","","","","","5","P 1","P 1","1","","","","- C2 N O17 P4 Ti2 -","- C2 N O17 P4 Ti2 -","- C2 N O17 P4 Ti2 -","1","1","","Mafra, Luís; Rocha, João; Fernandez, Christian; Castro, Germán R.; García-Granda, Santiago; Espina, Aranzazu; Khainakov, Sergei A.; García, José R.","Characterization of Layered γ-Titanium Phosphate (C2H5NH3)[Ti(H1.5PO4)(PO4)]2·H2O Intercalate: A Combined NMR, Synchrotron XRD, and DFT Calculations Study","Chemistry of Materials","2008","20","12","3944","","10.1021/cm800165p","","x-ray","0.82648","","","","","","","","","0.08421","","0.5","","","","","","","has coordinates","239742","2020-10-21","18:00:00",""
"4004036","9.4641","0.0004","5.479","0.0002","9.585","0.0004","90","","108.568","0.003","90","","471.15","0.03","","","7","","","","100","","","","","3","C 1 2/c 1","-C 2yc","15","BiCrO3 at 7 K","","","- Bi Cr O3 -","- Bi Cr O3 -","- Bi8 Cr8 O24 -","8","1","","Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E.","Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 7 K","Chemistry of Materials","2008","20","","3765","3769","10.1021/cm800375d","","","","","","","","","","","","","","","","","","","","","has coordinates","270195","2021-11-02","08:22:35",""
"4004037","9.4621","0.0004","5.4783","0.0002","9.5832","0.0004","90","","108.569","0.003","90","","470.9","0.03","","","50","","","","100","","","","","3","C 1 2/c 1","-C 2yc","15","BiCrO3 at 50 K","","","- Bi Cr O3 -","- Bi Cr O3 -","- Bi8 Cr8 O24 -","8","1","","Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E.","Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 50 K","Chemistry of Materials","2008","20","","3765","3769","10.1021/cm800375d","","","","","","","","","","","","","","","","","","","","","has coordinates","270196","2021-11-02","08:23:35",""
"4004038","9.462","0.0004","5.4781","0.0002","9.5835","0.0003","90","","108.568","0.003","90","","470.89","0.03","","","80","","","","100","","","","","3","C 1 2/c 1","-C 2yc","15","BiCrO3 at 80 K","","","- Bi Cr O3 -","- Bi Cr O3 -","- Bi8 Cr8 O24 -","8","1","","Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E.","Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 80 K","Chemistry of Materials","2008","20","","3765","3769","10.1021/cm800375d","","","","","","","","","","","","","","","","","","","","","has coordinates","270197","2021-11-02","08:24:33",""
"4004039","9.4658","0.0005","5.481","0.0002","9.5879","0.0004","90","","108.564","0.003","90","","471.56","0.04","","","130","","","","100","","","","","3","C 1 2/c 1","-C 2yc","15","BiCrO3 at 130 K","","","- Bi Cr O3 -","- Bi Cr O3 -","- Bi8 Cr8 O24 -","8","1","","Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E.","Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 130 K","Chemistry of Materials","2008","20","","3765","3769","10.1021/cm800375d","","","","","","","","","","","","","","","","","","","","","has coordinates","270198","2021-11-02","08:25:30",""
"4004040","5.54568","0.00012","7.7577","0.0002","5.42862","0.00012","90","","90","","90","","233.549","0.009","","","490","","","","100","","","","","3","P n m a","-P 2ac 2n","62","BiCrO3 perovskite at 490 K","","","- Bi Cr O3 -","- Bi Cr O3 -","- Bi4 Cr4 O12 -","4","0.5","","Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E.","Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 470 K perovskite structure","Chemistry of Materials","2008","20","","3765","3769","10.1021/cm800375d","","","","","","","","","","","","","","","","","","","","","has coordinates","270199","2021-11-02","08:26:20",""
"9017400","6.93145","","6.93145","","12.73617","","90","","90","","120","","529.929","","","","","","","","","","","","Synthetic","3","P 31","P 31","144","","","","- Ca2 O9 S2 -","- Ca6 O27 S6 -","- Ca6 O27 S6 -","","","","Christensen, A.; Olesen, M.; Cerenius, Y.; Jensen, T.","Formation and transformation of five different phases in the CaSO4-H2O system: crystal structure of the subhydrate beta-CaSO4*0.5H2O and soluble anhydrite CaSO4","Chemistry of Materials","2008","20","","2124","2132","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:59",""
"9017401","6.96895","","6.96865","","6.30044","","90","","90","","120","","264.983","","","","","","","","","","","","Synthetic","3","P 62 2 2","P 62 2 (0 0 4)","180","","","Anhydrite (soluble)","- Ca O4 S -","- Ca3 O12 S3 -","- Ca3 O12 S3 -","","","","Christensen, A.; Olesen, M.; Cerenius, Y.; Jensen, T.","Formation and transformation of five different phases in the CaSO4-H2O system: crystal structure of the subhydrate beta-CaSO4*0.5H2O and soluble anhydrite CaSO4","Chemistry of Materials","2008","20","","2124","2132","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:59",""