# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-17T13:56:17+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'F d d d :2' 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
"1000360","10.372","0.003","10.805","0.003","44.98","0.02","90","","90","","90","","5040.9","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Heptasodium distrontium tecto-fluoroheptaferrate(III)","","- F32 Fe7 Na7 Sr2 -","- F32 Fe7 Na7 Sr2 -","- F256 Fe56 Na56 Sr16 -","8","0.25","","Hemon-Ribaud, A; Greneche, J M; Courbion, G","Synthesis, crystal structure, and magnetic study of Na~7~Sr~2~Fe~7~F~32~","Journal of Solid State Chemistry","1994","112","","82","91","10.1006/jssc.1994.1269","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1000395","7.006","0.002","11.181","0.003","21.86499","0.006","90","","90","","90","","1712.8","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Potassium gadolinium carbonate difluoride","","- C F2 Gd K O3 -","- C F2 Gd K O3 -","- C16 F32 Gd16 K16 O48 -","16","0.5","","Mercier, N; Leblanc, M; Antic-Fidancev, E; Lemaitre-Blaise, M; Porcher, P","Structure and optical properties of K Gd (C O3) F2 : Eu(3+)","Journal of Alloys Compd.","1995","225","","198","202","10.1016/0925-8388(94)07093-8","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"1005023","5.723","0.002","10.04","0.003","26.05899","0.007","90","","90","","90","","1497.3","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Dipotassium phyllo-tetrathiotriniccolate","","- K2 Ni3 S4 -","- K2 Ni3 S4 -","- K16 Ni24 S32 -","8","0.25","","Elder, S H; Jobic, S; Brec, R; Gelabert, M; DiSalvo, F J","Structural and electronic properties of K2 Ni3 S4, a pseudo-two dimensional compound with a honeycomb-like arrangement","Journal of Alloys Compd.","1996","235","","135","142","10.1016/0925-8388(95)02064-0","","","","","","0.038","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1007207","27.779","0.02","12.385","0.006","7.026","0.004","90","","90","","90","","2417.2","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Silver dihydrogendiphosphate","","- Ag2 H2 O7 P2 -","- Ag2 H2 O7 P2 -","- Ag32 H32 O112 P32 -","16","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal structure of silver-dihydrogeno-diphospate: Ag~2~H~2~P~2~O~7~","European Journal of Solid State Inorganic Chemistry","1992","29","","993","999","","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008350","20.122","0.002","20.143","0.002","12.142","0.001","90","","90","","90","","4921.4","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Sodium neodymium tetragallium octasulfide","","- Ga4 Na Nd S8 -","- Ga4 Na Nd S8 -","- Ga64 Na16 Nd16 S128 -","16","0.5","","Ibanez, R; Gravereau, P; Garcia, A; Fouassier, C","Structural Study of NaNdGa~4~S~8~, a Luminescent Material with Low- Concentration Quenching","Journal of Solid State Chemistry","1988","73","","252","258","10.1016/0022-4596(88)90076-X","","","","","","0.064","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1008365","20.122","0.002","20.143","0.002","12.142","0.001","90","","90","","90","","4921.4","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Sodium neodymium tetragadolinium sulfide","","- Ga4 Na Nd S8 -","- Ga4 Na Nd S8 -","- Ga64 Na16 Nd16 S128 -","16","0.5","","Ibanez, R; Gravereau, P; Garcia, A; Fouassier, C","Structural Study of Na Nd Ga~4~ S~8~, a Luminescent Material with Low- Concentration Quenching","Journal of Solid State Chemistry","1988","73","","252","258","10.1016/0022-4596(88)90076-X","","","","","","0.064","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1011184","5.85","","12.29","","9.75","","90","","90","","90","","701","","","","","","","","","","","","synthetic","3","F d d d :2","-F 2uv 2vw","70","","Sodium sulfate(VI)","Thenardite","- Na2 O4 S -","- Na2 O4 S -","- Na16 O32 S8 -","8","0.25","","Zachariasen, W H; Ziegler, G E","The crystal structure of anhydrous sodium sulfate Na2 S O4","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","81","","92","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1101220","33.2107","0.0003","35.4445","0.0004","85.0187","0.0008","90","","90","","90","","100079","1.7","296.1","","","","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C100 H212 K8 O128 S2 Si2 Ti4 W20 -","- C100 K8 O128 S2 Si2 Ti4 W20 -","- C1600 K128 O2048 S32 Si32 Ti64 W320 -","16","0.5","","Goto, Yuya; Kamata, Keigo; Yamaguchi, Kazuya; Uehara, Kazuhiro; Hikichi, Shiro; Mizuno, Noritaka","Synthesis, Structural Characterization, and Catalytic Performance of Dititanium-Substituted γ-Keggin Silicotungstate","Inorganic Chemistry","2006","45","5","2347","2356","10.1021/ic052179q","","","0.71069","MoKα","","","0.0546","","","","0.0538","","","","","","8.293","","","","has coordinates","178223","2020-10-21","18:00:00",""
"1508125","28.083","0.003","59.645","0.006","82.288","0.008","90","","90","","90","","137833","2","110","2","110","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C288 H216 Cu24 O120 -","- C288 H216 Cu24 O120 -","- C2304 H1728 Cu192 O960 -","8","0.25","","Li, Jian-Rong; Zhou, Hong-Cai","Bridging-ligand-substitution strategy for the preparation of metal-organic polyhedra.","Nature chemistry","2010","2","10","893","898","10.1038/nchem.803","","","0.71073","MoKα","","0.1654","0.0744","","","0.158","0.1729","","","","","","1.024","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1509286","6.11","","14.473","","25.25","","90","","90","","90","","2232.86","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs2 (Ag Nb Se4)","","- Ag Cs2 Nb Se4 -","- Ag Cs2 Nb Se4 -","- Ag8 Cs16 Nb8 Se32 -","8","0.25","","Duerichen, P.; Rumpf, C.; Tillinski, R.; Bensch, W.; Schunk, S.A.; Jess, I.; Naether, C.","Synthesis, crystal structures, and optical properties of new quaternary metal chalcogenides of group 5: Cs2 Ag V S4, K2 Ag V Se4, Rb2 Ag V Se4, Rb2 Ag Nb S4, and Cs2 Ag Nb Se4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1285","1290","10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509287","5.846","","13.943","","24.241","","90","","90","","90","","1975.9","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs2 (Ag V S4)","","- Ag Cs2 S4 V -","- Ag Cs2 S4 V -","- Ag8 Cs16 S32 V8 -","8","0.25","","Bensch, W.; Duerichen, P.; Schunk, S.A.; Jess, I.; Tillinski, R.; Rumpf, C.; Naether, C.","Synthesis, crystal structures, and optical properties of new quaternary metal chalcogenides of group 5: Cs2 Ag V S4, K2 Ag V Se4, Rb2 Ag V Se4, Rb2 Ag Nb S4, and Cs2 Ag Nb Se4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1285","1290","10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509426","5.807","","12.939","","22.296","","90","","90","","90","","1675.25","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K2 (Ag V S4)","","- Ag K2 S4 V -","- Ag K2 S4 V -","- Ag8 K16 S32 V8 -","8","0.25","","Duerichen, P.; Bensch, W.","Crystal structure and preparation of K2 Ag V S4 and Rb2 Ag V S4 by using the molten flux method: Low-dimensional materials with infinite metal-ion-centered tetrahedra chains","Chemische Berichte","1996","129","","1207","1210","10.1002/cber.19961291011","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509427","5.972","","13.302","","23.099","","90","","90","","90","","1834.97","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K2 (Ag V Se4)","","- Ag K2 Se4 V -","- Ag K2 Se4 V -","- Ag8 K16 Se32 V8 -","8","0.25","","Tillinski, R.; Bensch, W.; Rumpf, C.; Schunk, S.A.; Jess, I.; Duerichen, P.; Naether, C.","Synthesis, crystal structures, and optical properties of new quaternary metal chalcogenides of group 5: Cs2 Ag V S4, K2 Ag V Se4, Rb2 Ag V Se4, Rb2 Ag Nb S4, and Cs2 Ag Nb Se4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1285","1290","10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509478","5.931","","13.57","","23.54","","90","","90","","90","","1894.59","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 (Ag Nb S4)","","- Ag Nb Rb2 S4 -","- Ag Nb Rb2 S4 -","- Ag8 Nb8 Rb16 S32 -","8","0.25","","Schunk, S.A.; Rumpf, C.; Tillinski, R.; Duerichen, P.; Bensch, W.; Naether, C.; Jess, I.","Synthesis, crystal structures, and optical properties of new quaternary metal chalcogenides of group 5: Cs2 Ag V S4, K2 Ag V Se4, Rb2 Ag V Se4, Rb2 Ag Nb S4, and Cs2 Ag Nb Se4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1285","1290","10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509519","5.82","","13.359","","23.184","","90","","90","","90","","1802.54","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 (Ag V S4)","","- Ag Rb2 S4 V -","- Ag Rb2 S4 V -","- Ag8 Rb16 S32 V8 -","8","0.25","","Bensch, W.; Duerichen, P.","Crystal structure and preparation of K2 Ag V S4 and Rb2 Ag V S4 by using the molten flux method: Low-dimensional materials with infinite metal-ion-centered tetrahedra chains","Chemische Berichte","1996","129","","1207","1210","10.1002/cber.19961291011","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509520","5.995","","13.7","","23.927","","90","","90","","90","","1965.16","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 (Ag V Se4)","","- Ag Rb2 Se4 V -","- Ag Rb2 Se4 V -","- Ag8 Rb16 Se32 V8 -","8","0.25","","Tillinski, R.; Schunk, S.A.; Jess, I.; Naether, C.; Bensch, W.; Rumpf, C.; Duerichen, P.","Synthesis, crystal structures, and optical properties of new quaternary metal chalcogenides of group 5: Cs2 Ag V S4, K2 Ag V Se4, Rb2 Ag V Se4, Rb2 Ag Nb S4, and Cs2 Ag Nb Se4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1285","1290","10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509700","5.796","","12.667","","10.2238","","90","","90","","90","","750.61","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ag2 (S O4)","","- Ag2 O4 S -","- Ag2 O4 S -","- Ag16 O32 S8 -","8","0.25","","von Dreele, R.B.; Brese, N.E.; Ramakrishna, B.L.; O'Keeffe, M.","Low-temperature structures of CuO and AgO and their relationships to those of MgO and PdO","Journal of Solid State Chemistry","1990","89","","184","190","10.1016/0022-4596(90)90310-T","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509733","8.613","","14.927","","19.639","","90","","90","","90","","2524.91","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ba4 Ag2 Si6","","- Ag2 Ba4 Si6 -","- Ag2 Ba4 Si6 -","- Ag16 Ba32 Si48 -","8","0.25","","Cardoso Gil, R.H.; Peters, K.; Grin', Yu.; Schultheiss, M.; Carrillo-Cabrera, W.; von Schnering, H.G.","New examples for the unexpected stability of the 10pi electron Hueckel arene (Si6)10-","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","285","293","10.1002/(SICI)1521-3749(199902)625:2<285::AID-ZAAC285>3.0.CO;2-V","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509797","8.42","","14.585","","17.864","","90","","90","","90","","2193.8","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Eu4 Ag2 Si6","","- Ag2 Eu4 Si6 -","- Ag2 Eu4 Si6 -","- Ag16 Eu32 Si48 -","8","0.25","","Peters, K.; Cardoso Gil, R.H.; von Schnering, H.G.; Schultheiss, M.; Carrillo-Cabrera, W.; Grin', Yu.","New examples for the unexpected stability of the 10pi electron Hueckel arene (Si6)10-","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","285","293","10.1002/(SICI)1521-3749(199902)625:2<285::AID-ZAAC285>3.0.CO;2-V","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510384","6.143","","14.296","","24.578","","90","","90","","90","","2158.45","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs2 (Au2 Sn S4)","","- Au2 Cs2 S4 Sn -","- Au2 Cs2 S4 Sn -","- Au16 Cs16 S32 Sn8 -","8","0.25","","Loeken, S.; Tremel, W.","Synthesis, Structures, and Properties of New Quaternary Gold-Chalcogenides: K2 Au2 Ge2 S6, K2 Au2 Sn2 Se6, and Cs2 Au2 Sn S4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1588","1594","10.1002/(SICI)1521-3749(199810)624:10<1588::AID-ZAAC1588>3.0.CO;2-X","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510674","10.672","","9.343","","6.014","","90","","90","","90","","599.647","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Eu Ir2 B2","","- B2 Eu Ir2 -","- B2 Eu Ir2 -","- B16 Eu8 Ir16 -","8","0.25","","Jung, W.","Ternaere Seltenerd-Iridiumboride SE Ir2 B2 (SE= Y, La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy) mit Ca Rh2 B2-Struktur","Journal of the Less-Common Metals","1991","171","","119","125","10.1016/0022-5088(91)90269-A","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510703","10.772","","9.275","","5.83","","90","","90","","90","","582.477","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Gd Ir2 B2","","- B2 Gd Ir2 -","- B2 Gd Ir2 -","- B16 Gd8 Ir16 -","8","0.25","","Jung, W.","Ternaere Seltenerd-Iridiumboride SE Ir2 B2 (SE= Y, La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy) mit Ca Rh2 B2-Struktur","Journal of the Less-Common Metals","1991","171","","119","125","10.1016/0022-5088(91)90269-A","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510721","10.832","","9.247","","5.751","","90","","90","","90","","576.04","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Y Ir2 B2","","- B2 Ir2 Y -","- B2 Ir2 Y -","- B16 Ir16 Y8 -","8","0.25","","Jung, W.","Ternaere Seltenerd-Iridiumboride SE Ir2 B2 (SE= Y, La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy) mit Ca Rh2 B2-Struktur","Journal of the Less-Common Metals","1991","171","","119","125","10.1016/0022-5088(91)90269-A","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510949","10.645","","9.379","","6.019","","90","","90","","90","","600.934","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ce Ir2 B2","","- B2 Ce Ir2 -","- B2 Ce Ir2 -","- B16 Ce8 Ir16 -","8","0.25","","Jung, W.","Ternaere Seltenerd-Iridiumboride SE Ir2 B2 (SE= Y, La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy) mit Ca Rh2 B2-Struktur","Journal of the Less-Common Metals","1991","171","","119","125","10.1016/0022-5088(91)90269-A","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511169","15.41","","7.86","","4.57","","90","","90","","90","","553.53","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","(Mo1.7 Ge0.3) B","","- B Ge0.3 Mo1.7 -","- B Ge0.3 Mo1.7 -","- B16 Ge4.8 Mo27.2 -","16","0.5","","Kuz'ma, Yu.B.; Marko, M.A.; Saakyan, L.S.","X-ray study of molybdenum-germanium-boron and tungsten-germanium- boron systems","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1976","12","","1307","1309","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511190","10.466","","9.154","","6.116","","90","","90","","90","","585.948","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Li Ir B","","- B Ir Li -","- B Ir Li -","- B16 Ir16 Li16 -","16","0.5","","Schmidt, B.; Jung, W.; Kluenter, W.","Li Ir B, Cu Ir B und Pd Ir B, ternaere Iridiumboride mit neuen, vom CaRh2B2-Typ abgeleiteten Strukturen","Journal of Alloys Compd.","1994","205","","93","100","10.1016/0925-8388(94)90772-2","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1513967","24.75193","0.00013","24.87184","0.00014","8.1995","0.00004","90","","90","","90","","5047.83","0.05","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Lithium Manganese(III) Manganese(IV) Oxide","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li72 Mn144 O288 -","72","2.25","","Piszora, P.","Temperature dependence of the order and distribution of Mn^3+^ and Mn^4+^ cations in orthorhombic LiMn~2~O~4~","Journal of Alloys and Compounds","2004","382","1-2","112","118","10.1016/j.jallcom.2004.06.013","","","","","","0.0393","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"1513968","24.76328","0.00027","24.80455","0.00026","8.1936","0.00007","90","","90","","90","","5032.85","0.09","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Lithium Manganese(III) Manganese(IV) Oxide","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li72 Mn144 O288 -","72","2.25","","Piszora, P.","Temperature dependence of the order and distribution of Mn^3+^ and Mn^4+^ cations in orthorhombic LiMn~2~O~4~","Journal of Alloys and Compounds","2004","382","1-2","112","118","10.1016/j.jallcom.2004.06.013","","","","","","0.0385","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"1513983","8.2692","0.0004","8.2468","0.0004","8.2205","0.0003","90","","90","","90","","560.59","0.04","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Lithium Manganese Oxide (1.13/2/4)","","- Li1.13 Mn2 O4 -","- Li1.13 Mn2 O4 -","- Li9.04 Mn16 O32 -","8","0.25","","Sato, K.; Poojary, D. M.; Clearfield, A.; Kohno, M.; Inoue, Y.","The surface structure of the proton-exchanged lithium manganese oxide spinels and their lithium-ion sieve properties","Journal of Solid State Chemistry","1997","131","","84","93","10.1006/jssc.1997.7348","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"1514020","24.75","0.003","24.801","0.002","8.1903","0.0009","90","","90","","90","","5027.4","0.9","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Lithium Manganese Oxide (1/2/4) - Lt","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li72 Mn144 O288 -","72","2.25","","Akimoto, J.; Takahashi, Y.; Kijima, N.; Gotoh, Y.","Single-crystal X-ray structure analysis of the low temperature form of Li Mn2 O4","Solid State Ionics","2004","172","","491","494","10.1016/j.ssi.2004.01.051","","","","","","0.0558","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514045","25.4788","","25.5137","","8.2687","","90","","90","","90","","5375.14","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Lithium Manganese Oxide (1/2/4)","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li72 Mn144 O288 -","72","2.25","","Nakayama, M.; Nogami, M.","A first-principles study on phase transition induced by charge ordering of Mn3+/Mn4+ in spinel Li Mn2 O4","Solid State Communications","2010","150","","1329","1333","10.1016/j.ssc.2010.05.006","","","","","","","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514891","13.8723","0.0004","17.3314","0.0003","37.589","0.0005","90","","90","","90","","9037.4","0.3","250","","250","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C52 H56 Cl2 -","- C52 H56 Cl2 -","- C416 H448 Cl16 -","8","0.25","","Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus","π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization","Polymer Chemistry","2013","4","10","2963","","10.1039/c3py00166k","","","0.71073","MoKα","","0.1039","0.0601","","0.1617","0.0766","0.0766","","","","","","1.0121","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1515478","22.6849","0.0012","37.2467","0.0018","45.91","0.003","90","","90","","90","","38791","4","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C120 H196 Dy6 Mn12 N8 O93 -","- C116 H140 Dy6 Mn12 N8 O69 -","- C928 H1120 Dy48 Mn96 N64 O552 -","8","0.25","","Liu, Jun-Liang; Guo, Fu-Sheng; Meng, Zhao-Sha; Zheng, Yan-Zhen; Leng, Ji-Dong; Tong, Ming-Liang; Ungur, Liviu; Chibotaru, Liviu F.; Heroux, Katie J.; Hendrickson, David N.","Symmetry related [DyIII6MnIII12] cores with different magnetic anisotropies","Chemical Science","2011","2","7","1268","","10.1039/c1sc00166c","","","0.71073","MoKα","","0.1483","0.0725","","","0.1795","0.2274","","","","","","0.919","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1517078","54.777","0.011","62.244","0.012","79.935","0.016","90","","90","","90","","272542","9","223","2","223","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C360 H464 Cd24 Ho8 N24 O144 -","- C360 H464 Cd24 Ho8 N24 O144 -","- C5760 H7424 Cd384 Ho128 N384 O2304 -","16","0.5","","Jones, Richard A.; Gnanam, Annie J.; Arambula, Jonathan; Jones, Jessica N.; Swaminathan, Jagannath; yang, xiao ping; Schipper, Desmond; Hall, Justin Walker; DePue, Lauren J.; Marcotte, Edward; Sessler, Jonathan; Ehrlich, Lauren I.; Brown, Katherine A.; Dieye, Yahkya; Vadivelu, Jamuna; Chandler, Don J.","FD175: Lanthanide Nano-drums: A New Class of Molecular Nanoparticles for Potential Biomedical Applications","Faraday Discussions","2014","","","","","10.1039/C4FD00117F","","","0.710747","MoKα","","0.2426","0.0923","","","0.1641","0.1812","","","","","","0.951","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1517276","15.689","0.004","30.833","0.008","33.866","0.009","90","","90","","90","","16382","7","200","","200","2","","","","","","","Synthesized by the authors. See text","5","F d d d :2","-F 2uv 2vw","70","","tetra(N,N'-diphenyl-4-pyrid-4-ylbenzamidinate) dirhodium, tetrahydrate","","- C96 H80 N12 O4 Rh2 -","- C96 H80 N12 O4 Rh2 -","- C768 H640 N96 O32 Rh16 -","8","0.25","","Chartrand, Daniel; Hanan, Garry S.","Optoelectronic properties and structural effects of the incremental addition of pyridyl moieties on a rhodium dimer.","The journal of physical chemistry. A","2014","118","45","10340","10352","10.1021/jp502243c","","","0.71073","MoKα","","0.0855","0.0375","","","0.0659","0.0734","","","","","","0.962","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1519024","8.5907","0.0005","11.3962","0.0008","44.49","0.003","90","","90","","90","","4355.6","0.5","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Ce2 Cu K Se6 -","- Ce2 Cu K Se6 -","- Ce32 Cu16 K16 Se96 -","16","0.5","","Klawitter, Y.; Nather, C.; Jeb, I.; Bensch, W.; Kanatzidis, M. G.","The superstructure of KCuCe2Se6 due to ordering of copper cations","Solid State Sciences","1999","1","","421","431","","","x-ray","0.71073","MoKα","","","0.0311","","","0.1081","","","","","","","1.21","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1521217","29.791","","29.873","","27.112","","90","","90","","90","","24128.2","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","(N H3) K3 C60","","- C60 H3 K3 N -","- C60 K3 N -","- C1920 K96 N32 -","32","1","","Ishii, K.; Iwasa, Y.; Watanuki, T.; Fujii, Y.; Fujiwara, A.; Mitani, T.; Suematsu, H.; Shimoda, H.; Murakami, Y.; Nakao, H.","Structural phase transition in the ammoniated alkali C60 compound (N H3) K3 C60","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","3956","3960","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521218","23.13","","10.51","","7.535","","90","","90","","90","","1831.73","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Na2 Eu3 (N H2)8","","- Eu3 H16 N8 Na2 -","- Eu3 N8 Na2 -","- Eu18 N48 Na12 -","6","0.1875","","Jacobs, H.; Fink, U.","Ueber Natrium- und Kaliumamidometallate des Calciums, Strontiums und Europiums","Journal of the Less-Common Metals","1979","63","","273","286","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521292","5.593","","9.788","","18.926","","90","","90","","90","","1036.09","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ti Sn Sb","","- Sb Sn Ti -","- Sb Sn Ti -","- Sb16 Sn16 Ti16 -","16","0.5","","Malaman, B.; Steinmetz, J.","Deux nouveaux ternaires a structures apparentees: Ti Sn Sb de type Cu Mg2 et Nb Sn Sb de type Cu Al2","Journal of the Less-Common Metals","1979","65","","285","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521406","10.239","","10.029","","6.3154","","90","","90","","90","","648.509","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Tb (V O4)","","- O4 Tb V -","- O4 Tb V -","- O32 Tb8 V8 -","8","0.25","","Kirschbaum, K.; Martin, A.; Parrish, D.A.; Pinkerton, A.A.","Cooperative Jahn-Teller induced phase transition of Tb V O4: singlecrystal structure analyses of the tetragonal high temperaturephaseand the twinned orthorhombic phase below 33 K","Journal of Physics: Condensed Matter","1999","11","","4483","4490","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522162","10.057","","14.064","","29.526","","90","","90","","90","","4176.21","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Ba3 I2 Si -","- Ba3 I2 Si -","- Ba48 I32 Si16 -","16","0.5","","Wengert, S.; Nesper, R.","Ba3 Si I2, a double salt of barium iodide and the Zintl phase Ba2 Si","Journal of Solid State Chemistry","2000","152","","460","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522163","10.064","","14.082","","29.605","","90","","90","","90","","4195.66","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ba3 I2 Ge","","- Ba3 Ge I2 -","- Ba3 Ge I2 -","- Ba48 Ge16 I32 -","16","0.5","","Wengert, S.; Nesper, R.","Ba3 Si I2, a double salt of barium iodide and the Zintl phase Ba2 Si","Journal of Solid State Chemistry","2000","152","","460","465","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1524700","21.37","","21.47","","12.72","","90","","90","","90","","5836.11","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Pb Ga2 Se4","","- Ga2 Pb Se4 -","- Ga2 Pb Se4 -","- Ga64 Pb32 Se128 -","32","1","","Klee, W.; Schaefer, H.","Zur Kenntnis von Pb Al2 Se4 und Pb Ga2 Se4","Materials Research Bulletin","1980","15","","1033","1038","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525581","23.22","","23.22","","14.17","","90","","90","","90","","7640.02","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Cu Br Te","","- Br Cu Te -","- Br Cu Te -","- Br96 Cu96 Te96 -","96","3","","Arai, M.; Sakuma, T.","Crystal structure of beta-(Cu Br Te)","Journal of the Physical Society of Japan","2001","70","","144","147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527110","11.65","","13.68","","17.57","","90","","90","","90","","2800.17","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","K2 (Sn F6) (H2 O)","","- F6 H2 K2 O Sn -","- F6 H2 K2 O Sn -","- F96 H32 K32 O16 Sn16 -","16","0.5","","Baidina, I.A.; Bakakin, V.V.; Borisov, S.V.; Podberezskaya, N.V.","Kristallicheskaya struktura monohidrata heksaflorstannatakaliya K2 Sn F6 (H2 O)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1976","17","","505","509","","","","","","","","","","","","","","","","","","","","","","has coordinates","186638","2020-10-21","18:00:00",""
"1527581","23.57","","11.31","","7.977","","90","","90","","90","","2126.48","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Eu K (N H2)3","","- Eu H6 K N3 -","- Eu K N3 -","- Eu16 K16 N48 -","16","0.5","","Jacobs, H.; Fink, U.","Untersuchung des Systems Kalium/Europium/Ammoniak","Zeitschrift fuer Anorganische und Allgemeine Chemie","1978","438","","151","159","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527742","9.787","","19.932","","9.705","","90","","90","","90","","1893.2","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","U O3","","- O3 U -","- O3 U -","- O96 U32 -","32","1","","Loopstra, B.O.; Waugh, A.B.; Taylor, J.C.","Neutron powder profile studies of the gamma uranium trioxide phases","Journal of Solid State Chemistry","1977","20","","9","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529123","11.251","","7.9806","","23.877","","90","","90","","90","","2143.91","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Lu2 Se3 -","- Lu1.996 Se3 -","- Lu31.936 Se48 -","16","0.5","","Folchnandt, M.; Schleid, T.; Schneck, C.","Ueber Sesquiselenide der Lanthanoide: Einkristalle von Ce2 Se3 im C-, Gd2 Se3 im U- und Lu2 Se3 im Z-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","149","155","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1529389","11.4483","0.0007","43.06","0.002","24.522","0.0014","90","","90","","90","","12088.5","1.2","143","1","143","1","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C68 H60 Ce Li4 N12 -","- C68 H60 Ce Li4 N12 -","- C544 H480 Ce8 Li32 N96 -","8","0.25","","Levin, Jessica R.; Dorfner, Walter L.; Carroll, Patrick J.; Schelter, Eric J.","Control of cerium oxidation state through metal complex secondary structures","Chem. Sci.","2015","6","12","6925","","10.1039/C5SC02607E","","","0.71073","MoKα","","0.03","0.0248","","","0.061","0.0639","","","","","","1.078","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"1531776","5.9611","","11.403","","17.179","","90","","90","","90","","1167.73","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","K3 (Fe2 O4)","","- Fe2 K3 O4 -","- Fe2 K3 O4 -","- Fe16 K24 O32 -","8","0.25","","Moeller, A.","Das gemischtvalente ternaere Oxoferrat(II,III) K3 (Fe2 O4) - eine aufgefuellte Variante des K2 (Fe2 O4) - Typs","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","2537","2541","","","","","","","","","","","","","","","","","","","","","","has coordinates","157333","2020-10-21","18:00:00",""
"1532236","27.521","","12.3519","","6.8597","","90","","90","","90","","2331.86","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Na2 (H2 P2 O7)","","- H2 Na2 O7 P2 -","- H2 Na2 O7 P2 -","- H32 Na32 O112 P32 -","16","0.5","","Selevich, K.A.; Ivashkevich, L.S.; Selevich, A.F.; Lyakhov, A.S.","Refinement of crystal structure of Na2 H2 P2 O7 using X-ray powder diffraction data","Zhurnal Neorganicheskoi Khimii","2002","47","","1672","1675","","","","","","","","","","","","","","","","","","","","","","has coordinates","157908","2020-10-21","18:00:00",""
"1532679","5.4892","","9.845","","19.151","","90","","90","","90","","1034.94","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ti Sn Sb","","- Sb Sn Ti -","- Sb Sn Ti -","- Sb16 Sn16 Ti16 -","16","0.5","","Dashjav, E.; Kleinke, H.","Sn/Sb atom ordering in the ternary stannide-antimonide Ti Sn Sb","Journal of Solid State Chemistry","2003","176","","329","337","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533877","11.689","","13.7492","","17.6484","","90","","90","","90","","2836.35","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","K2 (Sn F6) (H2 O)","","- F6 H2 K2 O Sn -","- F6 H2 K2 O Sn -","- F96 H32 K32 O16 Sn16 -","16","0.5","","Kavun, V.Ya.; Tkachenko, I.A.; Gabuda, S.P.; Gerasimenko, A.V.; Trofimov, G.L.","Crystal structure refinement of K2 Sn F6 * (H2 O) using single crystal (1)H NMR data","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2002","43","","382","386","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534192","6.95","","9.81","","20.82","","90","","90","","90","","1419.5","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","Ir Cl3","","- Cl3 Ir -","- Cl3 Ir -","- Cl48 Ir16 -","16","0.5","","Babel, D.; Deigner, P.","Die Kristallstruktur von Iridium(III)-Chlorid-beta","Zeitschrift fuer Anorganische und Allgemeine Chemie","1965","339","","57","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534477","10.971","","12.601","","16.035","","90","","90","","90","","2216.77","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs (Mo O2 (P O4))","","- Cs Mo O6 P -","- Cs Mo O6 P -","- Cs16 Mo16 O96 P16 -","16","0.5","","Leclaire, A.; Guesdon, A.; Borel, M.M.; Berrah, F.; Raveau, B.","Two molybdenum(VI) monophosphates with a tunnel structure : A Mo O2 P O4 (A = Cs, Tl) and structural relationships in the series.","Solid State Sciences","2001","3","","877","882","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534479","10.851","","12.452","","15.872","","90","","90","","90","","2144.57","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Tl (Mo O2 (P O4))","","- Mo O6 P Tl -","- Mo O6 P Tl -","- Mo16 O96 P16 Tl16 -","16","0.5","","Leclaire, A.; Guesdon, A.; Borel, M.M.; Berrah, F.; Raveau, B.","Two molybdenum(VI) monophosphates with a tunnel structure : A Mo O2 P O4 (A = Cs, Tl) and structural relationships in the series.","Solid State Sciences","2001","3","","877","882","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534581","28.596","","31.788","","38.347","","90","","90","","90","","34857.8","","","","","","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","K7 Na9 (Pt O (H2 O) (P W9 O34)2) (H2 O)21.5","","- H45 K7 Na9 O91.5 P2 Pt W18 -","- K7 Na9 O91.5 P2 Pt W18 -","- K112 Na144 O1464 P32 Pt16 W288 -","16","0.5","","Anderson, T.M.; Neiwert, W.A.; Kirk, M.L.; Rui Cao,; Piccoli, P.M.B.; Schultz, A.J.; Koetzle, F.; Hill, C.L.; Keiji Morokuma,; Musaev, D.G.","A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O)L2], L = [P W9 O34]9-","Science","2004","306","","2074","2077","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534583","28.637","","31.735","","38.228","","90","","90","","90","","34741.4","","","","","","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","H5.6 K7.6 Na1.4 ((Pd (H2 O)2)0.3 (W O (H2 O))0.7 (P W9 O34)2) (H2 O)20.5","","- H49.2 K7.6 Na1.4 O90.5 P2 Pd0.3 W18.7 -","- K7.6 Na1.4 O90.5 P2 Pd0.3 W18.7 -","- K121.6 Na22.4 O1448 P32 Pd4.8 W299.2 -","16","0.5","","Anderson, T.M.; Musaev, D.G.; Kirk, M.L.; Neiwert, W.A.; Schultz, A.J.; Piccoli, P.M.B.; Koetzle, F.","A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O)L2], L = [P W9 O34]9-","Science","2004","306","","2074","2077","","","","","","","","","","","","","","","","","","","","","","has coordinates","161423","2020-10-21","18:00:00",""
"1534585","28.494","","31.687","","37.988","","90","","90","","90","","34299","","","","","","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","K7 Na9 (Pt0.5 (O) (H2 O) (P W9 O34)2) (H2 O)21.5","","- H45 K7 Na9 O91.5 P2 Pt0.5 W18 -","- H7.78028 K7 Na9 O89.79 P2 Pt0.5 W18 -","- H124.484 K112 Na144 O1436.64 P32 Pt8 W288 -","16","0.5","","Anderson, T.M.; Neiwert, W.A.; Kirk, M.L.; Koetzle, F.; Piccoli, P.M.B.; Schultz, A.J.; Musaev, D.G.","A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O) L2], L = [P W9 O34]9-","Science","2004","306","","2074","2077","","","","","","","","","","","","","","","","","","","","","","has coordinates","161428","2020-10-21","18:00:00",""
"1535331","9.808","","5.281","","17.973","","90","","90","","90","","930.93","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ir (In1.3 Mg0.7)","","- In1.3 Ir Mg0.7 -","- In1.296 Ir Mg0.704 -","- In20.736 Ir16 Mg11.264 -","16","0.5","","Hlukhyy, V.; Poettgen, R.; Hoffmann, R.D.","Synthesis and crystal structures of the pseudobinary intermetallics Ir In2-x Mgx with orthorhombic Mg2 Cu structure and Ir Mg3-x Inx with hexagonal Cu3 P Type","Intermetallics","2004","12","","383","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535333","9.819","","5.288","","17.992","","90","","90","","90","","934.196","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ir (In1.47 Mg0.53)","","- In1.47 Ir Mg0.53 -","- In1.466 Ir Mg0.534 -","- In23.456 Ir16 Mg8.544 -","16","0.5","","Hlukhyy, V.; Hoffmann, R.D.; Poettgen, R.","Synthesis and crystal structures of the pseudobinary intermetallics Ir In2-x Mgx with orthorhombic Mg2 Cu structure and Ir Mg3-x Inx with hexagonal Cu3 P Type","Intermetallics","2004","12","","383","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535633","5.8134","","13.083","","23.164","","90","","90","","90","","1761.78","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 Li V S4","","- Li Rb2 S4 V -","- Li Rb2 S4 V -","- Li8 Rb16 S32 V8 -","8","0.25","","Huang, F.Q.; Deng, B.; Ibers, J.A.","Syntheses and structures of six compounds in the A2 Li M S4 (A = K, Rb, Cs; M = V, Nb, Ta) family","Journal of Solid State Chemistry","2005","178","","194","199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535637","5.8316","","13.6095","","24.177","","90","","90","","90","","1918.81","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs2 Li V S4","","- Cs2 Li S4 V -","- Cs2 Li S4 V -","- Cs16 Li8 S32 V8 -","8","0.25","","Huang, F.Q.; Ibers, J.A.; Deng, B.","Syntheses and structures of six compounds in the A2 Li M S4 (A = K, Rb, Cs; M = V, Nb, Ta) family","Journal of Solid State Chemistry","2005","178","","194","199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536008","9.679","","11.926","","30.691","","90","","90","","90","","3542.72","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Zn3 (Zn (H2 O)6) (H P O3)4","","- H16 O18 P4 Zn4 -","- H12 O18 P4 Zn4 -","- H96 O144 P32 Zn32 -","8","0.25","","Chen Wenbin; Xiang Shouhe; Li Niu","Zn3 (H P O3)4.Zn (H2 O)6: a purely inorganic open-framework zincophosphite with octahedral zinc complex (Zn (H2 O)6)(2+) encapsulating in the channels","Journal of Solid State Chemistry","2004","177","","3229","3234","","","","","","","","","","","","","","","","","","","","","","has coordinates","163562","2020-10-21","18:00:00",""
"1536138","8.297","","11.219","","18.661","","90","","90","","90","","1737.04","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","(U O2)2 (Si O4) (H2 O)2","","- H4 O10 Si U2 -","- O10 Si U2 -","- O80 Si8 U16 -","8","0.25","","Nozik, Yu.Z.; Kuznetsov, L.M.","Neutron diffraction study of synthetic soddyite by the full-profile analysis technique","Kristallografiya","1990","35","","1563","1564","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536619","24.18","","31.696","","58.012","","90","","90","","90","","44460.9","","","","","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Na14 K8 ((K (H2 O))4 (U O2)4 (O H)2 (Si W10 O36)4) (H2 O)62","","- K12 Na2 O220 Si4 U4 W40 -","- K12 Na2 O220 Si4 U4 W40 -","- K96 Na16 O1760 Si32 U32 W320 -","8","0.25","","Kim Kee-Chan; Gaunt, A.; Pope, M.T.","New heteropolytungstates incorporating dioxouranium(VI). Derivatives of alpha-(Si W9 O34)(10-), alpha-(As W9 O33)(9-), gamma-(Si W10 O36)(8-) and (As4 W40 O140)(28-)","Journal of Cluster Science","2002","13","","423","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","164401","2020-10-21","18:00:00",""
"1536626","10.7735","","7.7053","","22.837","","90","","90","","90","","1895.77","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Lu2 S3 -","- Lu2.007 S3 -","- Lu32.112 S48 -","16","0.5","","Kim, S.-J.; Anderegg, J.W.; Franzen, H.F.","Structure of a new intermediate Lu2-x S3","Journal of the Less-Common Metals","1990","157","","133","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537039","21.579","","21.336","","12.736","","90","","90","","90","","5863.78","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Eu Ga2 Se4 -","- Eu Ga2 Se4 -","- Eu32 Ga64 Se128 -","32","1","","Rimet, R.; Roques, R.; Declercq, J.P.; Zanchetta, J.V.; Germain, G.","Structure cristalline et proprietes magnetiques de Eu Ga2 Se4","Revue de Chimie Minerale","1981","18","","277","285","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537087","10.393","","12.762","","24.436","","90","","90","","90","","3241.08","","","","","","","","","","","","","1","F d d d :2","-F 2uv 2vw","70","","","","- S8 -","- S8 -","- S128 -","16","0.5","","Krossing, I.; Cameron, T.S.; Min Fang; Dionne, I.; Decken, A.; Passmore, J.","Approaching the gas phase structures of AgS8+ and AgS16+ in the solid state","Chemistry - A European Journal","2002","8","","3386","3401","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537136","6.8189","","15.063","","25.967","","90","","90","","90","","2667.15","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs2 (Mn Sn Te4)","","- Cs2 Mn Sn Te4 -","- Cs2 Mn Sn Te4 -","- Cs16 Mn8 Sn8 Te32 -","8","0.25","","Zimmermann, C.; Dehnen, S.","Cs2 (Mn Sn Te4): ungewoehnliche Synthese einer quaternaeren Phase mit eindimensionalen, ternaeren Anionenstraengen","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","1553","1556","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537523","21.06","","21","","12.66","","90","","90","","90","","5599.01","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Ca Ga2 Se4 -","- Ca Ga2 Se4 -","- Ca32 Ga64 Se128 -","32","1","","Klee, W.; Schaefer, H.","Darstellung und Struktur von Ba Al2 Se4, Ba Ga2 Se4, Ca Ga2 Se4 und Ca In2 Te4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1981","479","","125","133","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1543200","54.07","0.011","60.708","0.012","90.132","0.018","90","","90","","90","","295857","10","223","1","223","1","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C376 H490 Cd24 Cl4 N24 O136 Yb8 -","- C376 H490 Cd24 Cl4 N24 O136 Yb8 -","- C6016 H7840 Cd384 Cl64 N384 O2176 Yb128 -","16","0.5","","Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.","Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.","Nanoscale","2016","8","21","11123","11129","10.1039/c6nr00642f","","","0.710747","MoKα","","0.2013","0.0955","","","0.2258","0.242","","","","","","1.065","","","","has coordinates","183719","2020-10-21","18:00:00",""
"1543201","54.405","0.011","61.195","0.012","91.022","0.018","90","","90","","90","","303041","10","223","2","223","1","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C376 H490 Cd24 Cl4 N24 Nd8 O136 -","- C376 H490 Cd24 Cl4 N24 Nd8 O136 -","- C6016 H7840 Cd384 Cl64 N384 Nd128 O2176 -","16","0.5","","Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.","Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.","Nanoscale","2016","8","21","11123","11129","10.1039/c6nr00642f","","","0.710747","MoKα","","0.1798","0.1034","","","0.2692","0.3134","","","","","","0.935","","","","has coordinates","183719","2020-10-21","18:00:00",""
"1544300","9.2584","0.0018","12.936","0.002","15.764","0.003","90","","90","","90","","1888","0.6","100","2","100","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C12 H8 N2 -","- C12 H8 N2 -","- C96 H64 N16 -","8","0.25","","Bajpai, Alankriti; Scott, Hayley S.; Pham, Tony; Chen, Kai-Jie; Space, Brian; Lusi, Matteo; Perry, Miranda L.; Zaworotko, Michael J.","Towards an understanding of the propensity for crystalline hydrate formation by molecular compounds","IUCrJ","2016","3","6","","","10.1107/S2052252516015633","","","0.71073","MoKα","","0.1183","0.0812","","","0.2058","0.2284","","","","","","1.144","","","","has coordinates","187406","2020-10-21","18:00:00",""
"1548242","10.9218","0.0004","23.5976","0.0005","34.2826","0.0015","90","","90","","90","","8835.6","0.5","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C136 H144 Cu8 N24 O60 -","- C136 H144 Cu8 N24 O60 -","- C272 H288 Cu16 N48 O120 -","2","0.0625","","Fernández de Luis, Roberto; Larrea, Edurne S.; Orive, Joseba; Fidalgo-Marijuan, Arkaitz; Lezama, Luis; Arriortua, María I","Open and closed forms of the interpenetrated [Cu<sub>2</sub>(Tae)(Bpa)<sub>2</sub>](NO<sub>3</sub>)<sub>2</sub>·nH<sub>2</sub>O: magnetic properties and high pressure CO<sub>2</sub>/CH<sub>4</sub> gas sorption.","Dalton transactions (Cambridge, England : 2003)","2018","47","3","958","970","10.1039/c7dt04081d","","","0.71073","MoKα","","0.1328","0.0951","","","0.2491","0.2743","","","","","","1.089","","","","has coordinates,has disorder","230074","2020-10-21","18:00:00",""
"1548243","11.1575","0.001","23.7123","0.0015","33.583","0.003","90","","90","","90","","8885.1","1.3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C136 H144 Cu8 N24 O54.4 -","- C136 H144 Cu8 N24 O54.4 -","- C272 H288 Cu16 N48 O108.8 -","2","0.0625","","Fernández de Luis, Roberto; Larrea, Edurne S.; Orive, Joseba; Fidalgo-Marijuan, Arkaitz; Lezama, Luis; Arriortua, María I","Open and closed forms of the interpenetrated [Cu<sub>2</sub>(Tae)(Bpa)<sub>2</sub>](NO<sub>3</sub>)<sub>2</sub>·nH<sub>2</sub>O: magnetic properties and high pressure CO<sub>2</sub>/CH<sub>4</sub> gas sorption.","Dalton transactions (Cambridge, England : 2003)","2018","47","3","958","970","10.1039/c7dt04081d","","","0.71073","MoKα","","0.1236","0.1061","","","0.2744","0.2888","","","","","","1.149","","","","has coordinates,has disorder","230074","2020-10-21","18:00:00",""
"1548340","7.4477","","9.5989","","9.6888","","90","","90","","90","","692.65","","293","","293","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cl16 Cu16 O8 -","- Cl16 Cu16 O8 -","- Cl16 Cu16 O8 -","1","0.03125","","Li Zhao; Maria Teresa Fernandez-Diaz; Liu Hao Tjeng; Alexander C. Komarek","Oxyhalides: A new class of high-TC multiferroic materials","Science Advances","2016","2","","1600353","","10.1126/sciadv.1600353","","x-ray","0.71069","MoKα","","0.0308","0.0256","","","0.0689","0.072","","","","2.53","2.53","2.39","","","","has coordinates","203825","2020-10-21","18:00:00",""
"1548505","19.4287","0.0007","36.4741","0.0012","42.9932","0.0015","90","","90","","90","","30466.9","1.8","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C156 H120 Ag4 Cl12 O16 P8 -","- C156 H120 Ag4 Cl12 O16 P8 -","- C1248 H960 Ag32 Cl96 O128 P64 -","8","0.25","","Lin Rong Er","Gold rectangle, silver rings and helices - A study of self-assembly and molecular recognition of metallo-supramolecules","Ph.D Thesis - NATIONAL UNIVERSITY OF SINGAPORE","2005","","","1","","","","","0.71073","MoKα","","0.11","0.0843","","","0.2108","0.2263","","","","","","1.087","","","","has coordinates,has disorder","204407","2020-10-21","18:00:00",""
"1549307","54.777","0.011","61.944","0.012","79.935","0.016","90","","90","","90","","271228","9","190","1","190","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C386 H560 Cd24 N24 O190 Tb8 -","- C386 H560 Cd24 N24 O190 Tb8 -","- C6176 H8960 Cd384 N384 O3040 Tb128 -","16","0.5","","Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A.","A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging.","Chemical science","2018","9","20","4630","4637","10.1039/c8sc00650d","","","0.71073","MoKα","","0.2569","0.1275","","","0.3051","0.3226","","","","","","1.039","","","","has coordinates","228762","2020-10-21","18:00:00",""
"1549308","54.621","0.011","61.479","0.012","100.21","0.02","90","","90","","90","","336510","12","190","1","190","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C1714.04 H2526.4 Cd96 N96 O683.24 Tb32 -","- C1714.04 H2526.4 Cd96 N96 O683.24 Tb32 -","- C6856.16 H10105.6 Cd384 N384 O2732.96 Tb128 -","4","0.125","","Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A.","A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging.","Chemical science","2018","9","20","4630","4637","10.1039/c8sc00650d","","","0.71073","MoKα","","0.2097","0.0959","","","0.2256","0.2463","","","","","","1.084","","","","has coordinates","228762","2020-10-21","18:00:00",""
"1551281","15.2031","0.0009","21.8563","0.0013","43.312","0.003","90","","90","","90","","14391.9","1.6","180","","180","","","","","","","","Uni. of Cambridge, Chem. Dept, lab 301","5","F d d d :2","-F 2uv 2vw","70","","[TiO(OiPr)(Cy2PO2)]4","","- C60 H116 O16 P4 Ti4 -","- C60 H116 O16 P4 Ti4 -","- C480 H928 O128 P32 Ti32 -","8","0.25","","Kraemer, Tobias; Tuna, Floriana; Pike, Sebastian D.","Photo-redox reactivity of titanium-oxo clusters: mechanistic insight into a two-electron intramolecular process, and structural characterisation of mixed-valent Ti(III)/Ti(IV) products","Chemical Science","2019","","","","","10.1039/C9SC01241A","","","1.54178","CuKα","","0.0661","0.0566","","0.1872","0.1661","0.1872","","","","","","0.9833","","","","has coordinates,has disorder","215765","2020-10-21","18:00:00",""
"1551366","70.5877","0.0007","79.1494","0.001","80.8163","0.001","90","","90","","90","","451519","9","120","2","120","2","","","","","","","","9","F d d d :2","-F 2uv 2vw","70","","","","- C422 H343.5 Cl Co10 F114 N76 O46 P7.5 S23 -","- C403.5 H343.5 Cl Co10 F58.5 N67 O9 P7.5 S7.51 -","- C12912 H10992 Cl32 Co320 F1872 N2144 O288 P240 S240.32 -","32","1","","Imogen A. Riddell; Maarten M. J. Smulders; Jack K. Clegg; Yana R. Hristova; Boris Breiner; John D. Thoburn; Jonathan R. Nitschke","Anion-induced reconstitution of a self-assembling system to express a chloride-binding Co10L15 pentagonal prism","Nature Chemistry","2012","4","","751","756","10.1038/nchem.1407","","","1.54184","CuKα","","0.3405","0.2186","","","0.5124","0.5616","","","","","","1.736","","","","has coordinates,has disorder","215884","2020-10-21","18:00:00",""
"1551367","70.759","0.003","79.508","0.002","81.13","0.002","90","","90","","90","","456430","3","100","2","100","2","","","","","","","","9","F d d d :2","-F 2uv 2vw","70","","","","- C423 H345 Cl Co10 F111 N76 O47 P7 S23 -","- C407.5 H345 Cl Co10 F64.5 N68.5 O16 P7 S11.26 -","- C13040 H11040 Cl32 Co320 F2064 N2192 O512 P224 S360.32 -","32","1","","Imogen A. Riddell; Maarten M. J. Smulders; Jack K. Clegg; Yana R. Hristova; Boris Breiner; John D. Thoburn; Jonathan R. Nitschke","Anion-induced reconstitution of a self-assembling system to express a chloride-binding Co10L15 pentagonal prism","Nature Chemistry","2012","4","","751","756","10.1038/nchem.1407","","","0.6889","","","0.2646","0.2374","","","0.5673","0.5905","","","","","","1.657","","","","has coordinates,has disorder","215885","2020-10-21","18:00:00",""
"1554015","17.0726","0.0005","21.6048","0.0008","26.727","0.0007","90","","90","","90","","9858.3","0.5","290","2","290","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C12 H14 I N O -","- C12 H14 I N O -","- C384 H448 I32 N32 O32 -","32","1","","Sun, Xingxing; Zhang, Baicheng; Li, Xinyang; Trindle, Carl O.; Zhang, Guoqing","External Heavy-Atom Effect via Orbital Interactions Revealed by Single-Crystal X-ray Diffraction.","The journal of physical chemistry. A","2016","120","29","5791","5797","10.1021/acs.jpca.6b03867","","","0.71073","MoKα","","0.0533","0.0396","","","0.1253","0.1341","","","","","","1.073","","","","has coordinates","236433","2020-10-21","18:00:00",""
"1554349","24.1341","0.0014","25.4123","0.0013","26.638","0.0017","90","","90","","90","","16337.2","1.6","173","2","173.15","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C5.5 H5.62 N0.12 O0.5 -","- C5.5 H5.625 N0.125 O0.5 -","- C704 H720 N16 O64 -","128","4","","Gong, Hai-Xian; Cao, Zhu; Li, Meng-Hua; Liao, Sai-Hu; Lin, Mei-Jin","Photoexcited perylene diimide radical anions for the reduction of aryl halides: a bay-substituent effect","Organic Chemistry Frontiers","2018","5","15","2296","","10.1039/C8QO00445E","","","0.71073","MoKα","","0.0942","0.0766","","","0.2293","0.244","","","","","","1.068","","","","has coordinates","237146","2020-10-21","18:00:00",""
"1555262","7.3713","0.0011","22.951","0.004","23.585","0.004","90","","90","","90","","3990.1","1.1","200","","200","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C20 H28.9 O8 -","- C14 O8 -","- C112 O64 -","8","0.25","","Cui, Peng; McMahon, David P.; Spackman, Peter R.; Alston, Ben M.; Little, Marc A.; Day, Graeme M.; Cooper, Andrew I.","Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights","Chemical Science","2019","10","43","9988","","10.1039/C9SC02832C","","x-ray","0.71073","MoKα","","0.1034","0.0634","","","0.183","0.2143","","","","","","1.039","","","","has coordinates","238432","2020-10-21","18:00:00",""
"1557220","10.331","0.0008","12.6786","0.001","24.3519","0.0019","90","","90","","90","","3189.7","0.4","90","2","90","2","","","","","","","","1","F d d d :2","-F 2uv 2vw","70","","","","- S8 -","- S8 -","- S128 -","16","0.5","","MIKURIYA, Masahiro; TANIGUCHI, Kazuki; KOYAMA, Yoshiki; WATANABE, Hiroaki; YOSHIOKA, Daisuke; MITSUHASHI, Ryoji; ASATO, Eiji","Crystal Structure of S<sub>8</sub> Molecule from Thiourea","X-ray Structure Analysis Online","2020","36","0","1","2","10.2116/xraystruct.36.1","","","0.71073","MoKα","","0.0261","0.022","","","0.0563","0.057","","","","","","1.057","","","","has coordinates","258170","2020-10-21","18:00:00",""
"1557585","18.1194","0.0003","20.3557","0.0003","43.9834","0.0007","90","","90","","90","","16222.5","0.4","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C37 H61 Eu N8 O15 -","- C37 H47 Eu N8 O15 -","- C592 H752 Eu16 N128 O240 -","16","0.5","","Hewitt, Sarah H.; Macey, Georgina; Mailhot, Romain; Elsegood, Mark R. J.; Duarte, Fernanda; Kenwright, Alan M.; Butler, Stephen J.","Tuning the anion binding properties of lanthanide receptors to discriminate nucleoside phosphates in a sensing array","Chemical Science","2020","11","14","3619","3628","10.1039/D0SC00343C","","","0.71073","MoKα","","0.0487","0.0461","","","0.114","0.1153","","","","","","1.296","","","","has coordinates,has disorder","257355","2020-10-21","18:00:00",""
"1558822","7.0648","0.0004","26.4382","0.0014","45.215","0.003","90","","90","","90","","8445.3","0.9","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Fe2(bdp)3(DMF)0.58","Fe2(bdp)3","","- C39.44 H32.02 Fe2 N13.14 O1.15 -","- C39.432 H32.008 Fe2 N13.144 O1.144 -","- C315.456 H256.064 Fe16 N105.152 O9.152 -","8","0.25","","Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.","Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion","Chemical Science","2020","","","","","10.1039/D0SC03383A","","","0.8856","synchrotron","","0.0857","0.0718","","","0.2025","0.2123","","","","","","1.141","","","","has coordinates,has disorder","255227","2020-10-21","18:00:00",""
"1558823","7.0813","0.0016","26.493","0.007","45.483","0.012","90","","90","","90","","8533","4","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Na0.5Fe2(bdp)3","Na0.5Fe2(bdp)3","","- C36 H24 Fe2 N12 Na0.51 -","- C36 H24 Fe2 N12 Na0.492 -","- C288 H192 Fe16 N96 Na3.936 -","8","0.25","","Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.","Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion","Chemical Science","2020","","","","","10.1039/D0SC03383A","","","0.7288","synchrotron","","0.0674","0.0542","","","0.158","0.1677","","","","","","1.099","","","","has coordinates,has disorder","255227","2020-10-21","18:00:00",""
"1558824","7.081","0.003","26.535","0.009","45.388","0.019","90","","90","","90","","8528","6","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","K2Fe2(bdp)3","K2Fe2(bdp)3","","- C36 H24 Fe2 K2.01 N12 -","- C36 H24 Fe2 K2.04 N12 -","- C288 H192 Fe16 K16.32 N96 -","8","0.25","","Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.","Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion","Chemical Science","2020","","","","","10.1039/D0SC03383A","","","0.7288","synchrotron","","0.0606","0.0504","","","0.1394","0.1457","","","","","","1.143","","","","has coordinates,has disorder","255227","2020-10-21","18:00:00",""
"1558825","7.0835","0.0003","26.4668","0.0012","45.398","0.002","90","","90","","90","","8511.1","0.6","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Na2Fe2(bdp)3","Na2Fe2(bdp)3","","- C36 H24 Fe2 N12 Na2.04 -","- C36 H24 Fe2 N12 Na2.06 -","- C288 H192 Fe16 N96 Na16.48 -","8","0.25","","Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.","Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion","Chemical Science","2020","","","","","10.1039/D0SC03383A","","","0.7288","synchrotron","","0.0713","0.0568","","","0.1618","0.1747","","","","","","1.08","","","","has coordinates,has disorder","255227","2020-10-21","18:00:00",""
"1558826","7.0748","0.0003","26.4454","0.0009","45.3279","0.0017","90","","90","","90","","8480.7","0.6","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Li2Fe2(bdp)3","Li2Fe2(bdp)3","","- C36 H24 Fe2 Li2 N12 -","- C36 H24 Fe2 Li2 N12 -","- C288 H192 Fe16 Li16 N96 -","8","0.25","","Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.","Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion","Chemical Science","2020","","","","","10.1039/D0SC03383A","","","0.7288","synchrotron","","0.0731","0.0599","","","0.1766","0.1918","","","","","","1.166","","","","has coordinates,has disorder","255227","2020-10-21","18:00:00",""
"1559037","9.418","0.002","13.472","0.003","40.834","0.005","90","","90","","90","","5181","1.7","","","293","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","[CuL2](PF6)2","","","- C20 H18 Cu F12 N6 P2 -","- C20 Cu F12 N6 P2 -","- C160 Cu8 F96 N48 P16 -","8","0.25","","Sletten, Jorunn; Svardal, Kristin; Sorensen, Astrid","Coordination Geometries in Bis(di-2-pyridylamine)copper(II) Complexes. Crystal Structures of [CuL2](PF6)2, [CuL2(NO3)2] and [CuL2(NCS)1.5(ClO4)0.5][CuL2(NCS)]2(ClO4)2 (L = Di-2-pyridylamine)","Acta Chemica Scandinavica","1993","47","","1091","1099","10.3891/acta.chem.scand.47-1091","","x-ray","0.71073","MoKα","","","0.049","","","0.061","","","","","","","3.35","","","","has coordinates","279031","2022-11-07","10:58:29",""
"1559543","10.577","0.002","17.419","0.004","31.889","0.009","90","","90","","90","","5875","2","","","138","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","1,3,7,9,13,15,19,21-octaazaquinquecyclo [19.3.1.1(3,7).1(9,13).1(15,19)]octacosane","","","- C22 H44 Cl4 N8 -","- C22 H44 Cl4 N8 -","- C176 H352 Cl32 N64 -","8","0.25","","Dale, Johannes; Romming, Christian; Sigvartsen, Turid","Conformation of 1,3,7,9,13,15,19,21-octaazaquinquecyclo [19.3.1.1(3,7).1(9,13).1(15,19)]octacosane","Acta Chemica Scandinavica","1991","45","","1071","1075","10.3891/acta.chem.scand.45-1071","","x-ray","0.71069","MoKα","","","0.049","","","0.04","","","","","","","1.6","","","","has coordinates","259222","2020-11-23","08:51:09",""
"1560606","14.4277","0.0005","24.0577","0.0005","33.9348","0.0009","90","","90","","90","","11778.7","0.6","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C40 H60 N8 Ni4 O42 -","- C40 H60 N8 Ni4 O42 -","- C320 H480 N64 Ni32 O336 -","8","0.25","","Xu, Qing-Qing; Liu, Bing; Xu, Ling; Jiao, Huan","Ionothermal synthesis and structural transformation targeted by ion exchange in metal-1,3,5-benzenetricarboxylate compounds","Journal of Solid State Chemistry","2017","247","","1","7","10.1016/j.jssc.2016.12.006","","","0.71073","MoKα","","0.0462","0.0387","","","0.1072","0.1156","","","","","","1.008","","","","has coordinates","262187","2021-02-24","09:58:23",""
"1560607","14.3454","0.0006","24.1072","0.001","34.1451","0.0014","90","","90","","90","","11808.3","0.8","153","2","153","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C40 H56 Co4 N8 O42 -","- C40 H56 Co4 N8 O42 -","- C320 H448 Co32 N64 O336 -","8","0.25","","Xu, Qing-Qing; Liu, Bing; Xu, Ling; Jiao, Huan","Ionothermal synthesis and structural transformation targeted by ion exchange in metal-1,3,5-benzenetricarboxylate compounds","Journal of Solid State Chemistry","2017","247","","1","7","10.1016/j.jssc.2016.12.006","","","0.71073","MoKα","","0.0542","0.0465","","","0.1275","0.1378","","","","","","1.04","","","","has coordinates","262188","2021-02-24","10:00:12",""
"1560839","11.746","0.002","42.15","0.004","51.849","0.002","90","","90","","90","","25670","5","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C52 H61 Co3 N8 O19.5 S6 -","- C40 H30 Co3 N4 O14 S6 -","- C640 H480 Co48 N64 O224 S96 -","16","0.5","","Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P.","3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties.","Molecules (Basel, Switzerland)","2021","26","5","1269","","10.3390/molecules26051269","","","0.79313","synchrotron","","0.0442","0.0361","","","0.0961","0.0997","","","","","","1.073","","","","has coordinates","262761","2021-03-05","13:38:28",""
"1560999","16.693","0.006","21.059","0.007","89.25","0.03","90","","90","","90","","31375","19","296","2","296.15","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C56 H46 N8 Ni2 O8 Si -","- C56 H46 N8 Ni2 O8 Si -","- C896 H736 N128 Ni32 O128 Si16 -","16","0.5","","Li, Qi; Guo, Tiantian; Lv, Xin; Lin, Yifang; Dai, Zhihui; Fang, Min; Bao, Jianchun; Wu, Yong","Two Ni(II) semiconducting metal-organic frameworks based on the tetrakis(4-carboxyphenyl)silane and an imidazole ligand: Syntheses, characterization, water stability and photoelectric properties","Journal of Solid State Chemistry","2018","265","","100","108","10.1016/j.jssc.2018.05.010","","","0.71073","MoKα","","0.1076","0.0672","","","0.1406","0.1652","","","","","","1.118","","","","has coordinates","262972","2021-03-10","10:44:18",""
"1561211","19.0611","0.0009","23.7425","0.0011","27.1964","0.0011","90","","90","","90","","12308","1","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C28 H30 Cu F4 N8 O6 -","- C28 H30 Cu F4 N8 O6 -","- C448 H480 Cu16 F64 N128 O96 -","16","0.5","","Liu, Kang; Sun, Yayong; Deng, Liming; Cao, Fan; Han, Jishu; Wang, Lei","Cu(II) coordination polymers constructed by tetrafluoroterephthalic acid and varied imidazole-containing ligands: Syntheses, structures and properties","Journal of Solid State Chemistry","2018","258","","24","31","10.1016/j.jssc.2017.10.002","","","0.71073","MoKα","","0.0803","0.0643","","","0.1919","0.21","","","","","","1.074","","","","has coordinates","263252","2021-03-23","09:24:35",""
"1561470","16.7082","0.0009","20.8465","0.0015","21.0159","0.0014","90","","90","","90","","7320","0.8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- Cu H2 I3 O2 Pb2 -","- Cu I3 O2 Pb2 -","- Cu32 I96 O64 Pb64 -","32","1","","Welch, Mark D.; Rumsey, Michael S.; Kleppe, Annette K.","A naturally-occurring new lead-based halocuprate(I)","Journal of Solid State Chemistry","2016","238","","9","14","10.1016/j.jssc.2016.03.005","","","0.71073","MoKα","","0.0584","0.0369","","","0.0518","0.0572","","","","","","1.016","","","","has coordinates","263553","2021-04-02","09:39:18",""
"1561471","16.7082","0.0009","20.8465","0.0015","21.0159","0.0014","90","","90","","90","","7320","0.8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- Cu H2 I3 O2 Pb2 -","- Cu Im3 Om2 Pb2 -","- Cu32 Im96 Om64 Pb64 -","32","1","","Welch, Mark D.; Rumsey, Michael S.; Kleppe, Annette K.","A naturally-occurring new lead-based halocuprate(I)","Journal of Solid State Chemistry","2016","238","","9","14","10.1016/j.jssc.2016.03.005","","","0.71073","MoKα","","0.0585","0.037","","","0.0519","0.0573","","","","","","1.016","","","","has coordinates","263553","2021-04-02","09:39:27",""
"1562461","14.118","0.002","20.636","0.003","37.423","0.006","90","","90","","90","","10903","3","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","((BMe2,EtTCH)2)U","","","- C40 H56 B4 N16 U -","- C40 H56 B4 N16 U -","- C320 H448 B32 N128 U8 -","8","0.25","","DeJesus, Joseph F.; Kerr, Ryan W. F.; Penchoff, Deborah A.; Carroll, Xian B.; Peterson, Charles C.; Arnold, Polly L.; Jenkins, David M.","Actinide tetra-N-heterocyclic carbene ‘sandwiches’","Chemical Science","2021","","","","","10.1039/D1SC01007G","","","0.71073","MoKα","","0.0549","0.0435","","","0.099","0.1032","","","","","","1.039","","","","has coordinates","265076","2021-05-11","00:58:09",""
"1563767","5.2625","0.0005","9.0278","0.0008","18.307","0.0016","90","","90","","90","","869.74","0.14","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Cu Mg2 -","- Cu Mg2 -","- Cu16 Mg32 -","16","0.5","","Braga, M.H.; Ferreira, J.J.A.; Siewenie, J.; Proffen, Th.; Vogel, S.C.; Daemen, L.L.","Neutron powder diffraction and first-principles computational studies of CuLixMg2−x (x≅0.08), CuMg2, and Cu2Mg","Journal of Solid State Chemistry","2010","183","1","10","19","10.1016/j.jssc.2009.09.010","","","","","","","","","","","","","","","","","","","","","has coordinates","266770","2021-06-29","09:06:48",""
"1563792","26.6681","0.0012","31.3068","0.0013","56.946","0.002","90","","90","","90","","47544","3","296","2","296","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C105 H72 O33 Pb11 -","- C105 H72 O33 Pb11 -","- C1680 H1152 O528 Pb176 -","16","0.5","","Xiao, Jun-Xia; Ma, De-Yun","Syntheses, structures, luminescent and catalytic properties of two 3D metal-organic frameworks","Inorganica Chimica Acta","2018","483","","6","11","10.1016/j.ica.2018.07.054","","","0.71073","MoKα","","0.0706","0.0405","","","0.0873","0.0974","","","","","","1.023","","","","has coordinates,has disorder","266806","2021-06-30","09:18:37",""
"1563858","12.506","0.012","22.88","0.02","24.7","0.02","90","","90","","90","","7068","11","566","2","566.3","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C24 H16 Cu N4 O8 Yb -","- C24 H16 Cu N4 O8 Yb -","- C192 H128 Cu8 N32 O64 Yb8 -","8","0.25","","Xiong, Gang; Qi, Dan; He, Yongke; You, Lixin; Ren, Baoyi; Sun, Yaguang","Lanthanide contraction and anion-controlled structure diversity in two types of novel 3d-4f heterometallic coordination polymers: Crystal structure and magnetic properties","Inorganica Chimica Acta","2018","483","","299","304","10.1016/j.ica.2018.08.044","","","0.71073","MoKα","","0.0858","0.0746","","","0.1704","0.1827","","","","","","1.048","","","","has coordinates,has Fobs","266874","2021-07-01","09:38:47",""
"1565408","15.926","0.002","18.696","0.003","26.925","0.004","90","","90","","90","","8017","2","200","2","200","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","TMAVBH","Tetramethylammonium vanadium(v)-bis-hydroxyiminodiacetate","","- C12 H25 N3 O12 V -","- C12 H25 N3 O12 V -","- C192 H400 N48 O192 V16 -","16","0.5","","Visayas, Benjoe Rey Baguio; Pahari, Shyam K.; Gokoglan, Tugba Ceren; Golen, James A.; Agar, Ertan; Cappillino, Patrick; Mayes, Maricris Lodriguito","Computational and Experimental Investigation of the Effect of Cation Structure on the Solubility of Anionic Flow Battery Active-Materials","Chemical Science","2021","","","","","10.1039/D1SC04990A","","","0.71073","MoKα","","0.0392","0.0297","","","0.0715","0.0759","","","","","","1.096","","","","has coordinates","270892","2021-11-26","23:13:13",""
"1566198","28.0557","0.0013","31.8586","0.0013","36.449","0.0012","90","","90","","90","","32579","2","220","","220","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C68 H48 F16 O8 -","- C68 H48 F16 O8 -","- C1088 H768 F256 O128 -","16","0.5","","Mirzaei, Saber; Espinoza Castro, Victor M.; Hernández Sánchez, Raúl","Nonspherical anion sequestration by C–H hydrogen bonding","Chemical Science","2022","","","","","10.1039/D1SC07041J","","x-ray","1.54178","CuKα","","0.3117","0.2524","","","0.5948","0.6582","","","","","","2.369","","","","has coordinates,has disorder","272358","2022-01-31","23:10:09",""
"1567064","12.556","0.0003","26.6378","0.0007","45.7727","0.001","90","","90","","90","","15309.3","0.6","193","2","193","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C70 H89 N O12 -","- C70 H89 N O12 -","- C560 H712 N8 O96 -","8","0.25","","Cao, Jiajun; Wu, Yitao; Li, Qi; Zhu, Weijie; Wang, Zeju; Liu, Yang; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe","Separation of pyrrolidine from tetrahydrofuran by pillar[6]arene-based nonporous adaptive crystals","Chemical Science","2022","","","","","10.1039/D2SC02494B","","","1.34139","GaKα","","0.1093","0.0929","","","0.2533","0.2659","","","","","","1.034","","","","has coordinates,has disorder","275752","2022-06-02","22:18:03",""
"1567115","16.1557","0.0009","30.2077","0.0017","58.888","0.004","90","","90","","90","","28739","3","296","2","296.15","","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C72 H48 Ag13 F18 N6 O18 S6 -","- C72 H48 Ag13 F18 N6 O18 S6 -","- C576 H384 Ag104 F144 N48 O144 S48 -","8","0.25","","Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang","Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction.","Chemical science","2022","13","27","8095","8103","10.1039/d2sc00989g","","","0.71073","MoKα","","0.1873","0.134","","","0.3601","0.4086","","","","","","1.078","","","","has coordinates,has disorder","277099","2022-08-06","11:41:47",""
"1567668","12.2216","0.0005","20.5008","0.0009","20.8426","0.001","90","","90","","90","","5222.2","0.4","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Ga2 S4 Sr -","- Ga2 S4 Sr -","- Ga64 S128 Sr32 -","32","1","","Yang, He-Di; Ran, Mao-Yin; Zhou, Sheng-Hua; Wu, Xin-Tao; Lin, Hua; Zhu, Qi-Long","Rational design via dual-site aliovalent substitution leads to an outstanding IR nonlinear optical material with well-balanced comprehensive properties","Chemical Science","2022","13","36","10725","10733","10.1039/D2SC03760B","","","0.71073","MoKα","","0.0338","0.0228","","","0.0591","0.0627","","","","","","1.174","","","","has coordinates","278050","2022-09-21","22:06:19",""
"1567748","9.97","0.0004","11.8236","0.0005","13.3559","0.0005","90","","90","","90","","1574.41","0.11","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","2-imidizolidinone","2-imidizolidinone","","- C3 H6 N2 O -","- C3 H6 N2 O -","- C48 H96 N32 O16 -","16","0.5","","Bellas, Michael K.; Matzger, Adam J.","Discovery strategy leads to the first melt-castable cocrystal based on an energetic oxidizing salt","Chemical Science","2022","13","41","12100","12106","10.1039/D2SC03015B","","","1.54184","CuKα","","0.0535","0.0524","","","0.1273","0.1285","","","","","","1.136","","","","has coordinates","278969","2022-11-07","05:14:20",""
"1569994","9.8404","0.0004","21.4458","0.0008","67.537","0.003","90","","90","","90","","14252.7","1","90","","90","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C68 H56 Co N4 O2 S4 -","- C68 H56 Co N4 O2 S4 -","- C544 H448 Co8 N32 O16 S32 -","8","0.25","","Mitchell, Travis B.; Zhang, Xiaotong; Jerozal, Ronald T.; Chen, Yu Sheng; Wang, SuYin; Benedict, Jason B.","Development of a scalar-based geometric parameterization approach for the crystal structure landscape of dithienylethene-based crystalline solids.","IUCrJ","2023","10","6","","","10.1107/S2052252523008060","","","0.71073","MoKα","","0.0663","0.048","","","0.1055","0.1143","","","","","","1.034","","","","has coordinates","286553","2023-09-27","02:10:27",""
"1569995","9.8621","0.0006","21.6164","0.0013","67.069","0.004","90","","90","","90","","14298","1.5","100","","100","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C68 H56 N4 Ni O2 S4 -","- C68 H56 N4 Ni O2 S4 -","- C544 H448 N32 Ni8 O16 S32 -","8","0.25","","Mitchell, Travis B.; Zhang, Xiaotong; Jerozal, Ronald T.; Chen, Yu Sheng; Wang, SuYin; Benedict, Jason B.","Development of a scalar-based geometric parameterization approach for the crystal structure landscape of dithienylethene-based crystalline solids.","IUCrJ","2023","10","6","","","10.1107/S2052252523008060","","","0.41328","synchrotron","","0.0435","0.0378","","","0.0977","0.1011","","","","","","1.086","","","","has coordinates","286553","2023-09-27","02:10:27",""
"1569996","9.8296","0.0005","21.4844","0.0012","67.4","0.004","90","","90","","90","","14233.7","1.4","90","","90","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C68 H56 N6 O8 S4 Zn -","- C68 H56 N6 O8 S4 Zn -","- C544 H448 N48 O64 S32 Zn8 -","8","0.25","","Mitchell, Travis B.; Zhang, Xiaotong; Jerozal, Ronald T.; Chen, Yu Sheng; Wang, SuYin; Benedict, Jason B.","Development of a scalar-based geometric parameterization approach for the crystal structure landscape of dithienylethene-based crystalline solids.","IUCrJ","2023","10","6","","","10.1107/S2052252523008060","","","0.71073","MoKα","","0.0965","0.0863","","","0.2209","0.2268","","","","","","1.21","","","","has coordinates,has disorder","286553","2023-09-27","02:10:27",""
"1569997","9.8116","0.0012","21.432","0.003","69.162","0.008","90","","90","","90","","14544","3","90","","90","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C68 H56 Cd N6 O8 S4 -","- C68 H56 Cd N6 O8 S4 -","- C544 H448 Cd8 N48 O64 S32 -","8","0.25","YC5044","Mitchell, Travis B.; Zhang, Xiaotong; Jerozal, Ronald T.; Chen, Yu Sheng; Wang, SuYin; Benedict, Jason B.","Development of a scalar-based geometric parameterization approach for the crystal structure landscape of dithienylethene-based crystalline solids.","IUCrJ","2023","10","6","","","10.1107/S2052252523008060","","","0.71073","MoKα","","0.0937","0.0927","","","0.2321","0.2326","","","","","","1.268","","","","has coordinates,has disorder","286553","2023-09-27","02:10:27",""
"1570365","23.4478","0.0013","30.2351","0.0016","48.07","0.003","90","","90","","90","","34079","3","273.15","","273.15","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C142 H140 Ni10 O S20 -","- C142 H140 Ni10 O S20 -","- C1136 H1120 Ni80 O8 S160 -","8","0.25","","Fan, Ji-Qiang; Cen, Kehui; Xu, Hua-Jun; Wang, Hai-Yang; Yang, Ying; Zhu, Ze-Min; Liu, Hao; Chen, Dengyu; Fan, Weigang; Li, Man-Bo","Photochemical synthesis of group 10 metal nanoclusters for electrocatalysis.","Nanoscale","2023","15","47","19079","19084","10.1039/d3nr05328h","","","1.54178","CuKα","","0.0688","0.0487","","","0.1357","0.1462","","","","","","1.026","","","","has coordinates","288826","2024-01-06","08:30:48",""
"1570892","23.4881","0.0012","30.1131","0.0018","48.101","0.003","90","","90","","90","","34022","3","296","2","296","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Ni10(pMPT)20","","- C140 H140 Ni10 S20 -","- C140 H140 Ni10 S20 -","- C1120 H1120 Ni80 S160 -","8","0.25","","Xiang, Huixin; Cheng, Ranran; Ruan, Chenhao; Meng, Changqing; Gan, Yuzheng; Cheng, Wanyu; Zhao, Yue; Xu, Cong-Qiao; Li, Jun; Yao, Chuanhao","A homologous series of macrocyclic Ni clusters: synthesis, structures, and catalytic properties.","Nanoscale","2024","16","9","4563","4570","10.1039/d3nr06015b","","","0.71073","MoKα","","0.0845","0.0413","","","0.1216","0.1648","","","","","","0.959","","","","has coordinates","291008","2024-04-04","23:57:38",""
"2002180","9.699","","9.603","","7.462","","90","","90","","90","","695","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Dicopper dichloride oxide","Melanothallite","- Cl2 Cu2 O -","- Cl2 Cu2 O -","- Cl16 Cu16 O8 -","8","0.25","","Arpe, R; Mueller-Buschbaum, Hk","","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1977","32","","380","382","","","","","","","0.112","","","","","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"2003173","36.394","0.001","7.3674","0.0005","31.006","0.002","90","","90","","90","","8313.6","0.8","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","calcium_zirconium_tantalum_oxide","","- Ca7 O36 Ta6 Zr7 -","- Ca6.98667 O36 Ta5.94667 Zr7.06667 -","- Ca83.84 O432 Ta71.36 Zr84.8 -","12","0.375","BR0081","Schmid, Siegbert; Thompson, John G.; Withers, Ray L.; Ling, Christopher D.; Ishizawa, Nobuo; Kishimoto, Shunji","The crystal structure of Ca~7~Zr~7~Ta~6~O~36~ refined using synchrotron-radiation data","Acta Crystallographica Section B","1999","55","3","313","320","10.1107/S0108768198014268","","","1.2682","xray","","0.047","0.031","","0.038","0.034","","","","1.379","1.508","1.508","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006506","16.2226","0.0013","17.8756","0.0015","19.0452","0.0018","90","","90","","90","","5522.9","0.8","150","2","150","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","1,2,4,5-Tetrakis(trimethylsilylmethyl)benzene","","- C22 H46 Si4 -","- C22 H46 Si4 -","- C176 H368 Si32 -","8","0.25","JZ1201","Nagel, Norbert; Ansari, Manssur; Bock, Hans","1,2,4,5-Tetrakis(trimethylsilylmethyl)benzene at 150K","Acta Crystallographica Section C","1997","53","9","1329","1331","10.1107/S0108270197005179","","","0.71073","MoKα","","0.0472","0.0356","","0.0927","0.0862","","","","1.089","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008571","12.694","0.005","16.353","0.005","11.122","0.003","90","","90","","90","","2308.8","1.3","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rubidium molybdyl arsenate","","- As Mo O6 Rb -","- As Mo O6 Rb -","- As16 Mo16 O96 Rb16 -","16","0.5","GS1008","Zid, Mohamed Faouzi; Jouini, Tahar","RbMoO~2~AsO~4~","Acta Crystallographica Section C","1999","55","6","843","845","10.1107/S0108270198016102","","","0.71069","MoKα","","0.0335","0.024","","0.0674","0.0553","","","","1.173","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2010504","11.7643","0.0002","19.9965","0.0003","32.9889","0.0003","90","","90","","90","","7760.47","0.19","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","μ-(4,4'-Bipyridine)-N:N'-bis[bis(pyrrolidinedithiocarboxylato-S,S')zinc(II)]","","- C30 H40 N6 S8 Zn2 -","- C30 H40 N6 S8 Zn2 -","- C240 H320 N48 S64 Zn16 -","8","0.25","BK1483","Chen, Xiao-Feng; Liu, Shu-Hua; Zhu, Xu-Hui; Vittal, Jagadese J.; Tan, Goek-Kheng; You, Xiao-Zeng","μ-(4,4'-Bipyridine)-<i>N</i>:<i>N</i>'-bis[bis-(pyrrolidinedithiocarboxylato-<i>S</i>,<i>S</i>')zinc(II)]","Acta Crystallographica Section C","2000","56","1","42","43","10.1107/S0108270199012706","","","0.71073","MoKα","","0.061","0.046","","0.121","0.112","","","","1.078","1.12","1.12","","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2010573","6.9804","0.0008","19.256","0.002","26.131","0.003","90","","90","","90","","3512.4","0.7","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C7 H11 Br N2 -","- C7 H11 Br N2 -","- C112 H176 Br16 N32 -","16","0.5","QB0146","Mayr-Stein, Ralf; Bolte, Michael","4-Dimethylaminopyridinium bromide","Acta Crystallographica Section C","2000","56","1","e19","e20","10.1107/S0108270199016133","","","0.71073","MoKα","","0.064","0.036","","","","0.1","","","","","","1.018","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2011333","10.914","0.001","21.758","0.001","32.774","0.001","90","","90","","90","","7782.7","0.8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Bis-(12-Krone-4)-cadmium-bispentaiodid","Bis-(1,3,5,7-Tetraoxacyclododecan)-cadmium-bis-pentaiodid","","- C16 H32 Cd I10 O8 -","- C16 H32 Cd I10 O8 -","- C128 H256 Cd8 I80 O64 -","8","0.25","JZ1406","Wieczorrek, Carsten","Isolierte I~10~^2{-^}-Ringe, ein neues Strukturelement in der Polyiodid-Chemie","Acta Crystallographica Section C","2000","56","9","1082","1084","10.1107/S0108270100008817","","","0.7107","MoKα","","0.034","0.0313","","0.0643","","0.063","","","1.086","","","1.104","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011430","6.5948","0.0017","9.493","0.003","19.64","0.005","90","","90","","90","","1229.6","0.6","298","2","298","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","sodium calcium tantalate","trisodium dicalcium tantalum hexoxide","","- Ca2 Na3 O6 Ta -","- Ca2 Na3 O6 Ta -","- Ca16 Na24 O48 Ta8 -","8","0.25","OA1102","Yamane, Hisanori; Takahashi, Hiroki; Kajiwara, Takashi; Shimada, Masahiko","Na~3~Ca~2~TaO~6~, a rock-salt superstructure phase with a fully ordered cation arrangement","Acta Crystallographica Section C","2000","56","10","1177","1178","10.1107/S0108270100009306","","","0.71073","MoKα","","0.024","0.015","","","","0.035","","","","","","1.13","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2013790","9.0573","0.0007","17.1999","0.0013","37.754","0.009","90","","90","","90","","5881.5","1.5","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","(pyrimidine-2-thionato-κS)(pyrimidinium-2-thionato-κS)mercury(II) tetrabromomercury(II)","","- C16 H14 Br4 Hg3 N8 S4 -","- C16 H14 Br4 Hg3 N8 S4 -","- C128 H112 Br32 Hg24 N64 S32 -","8","0.25","GD1289","Matković-Čalogović, Dubravka; Mrvoš-Sermek, Draginja; Popović, Zora; Soldin, Željka","A new complex of HgBr~2~ and pyrimidine-2-thione: (pyrimidine-2-thionato-κ<i>S</i>)(pyrimidinium-2-thionato-κ<i>S</i>)mercury(II) tetrabromomercury(II)","Acta Crystallographica Section C","2004","60","2","m44","m46","10.1107/S0108270103028014","","","0.71073","MoKα","","0.101","0.054","","","0.126","0.145","","","","","","1.033","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2017053","12.1763","0.0002","13.3596","0.0002","27.2064","0.0006","90","","90","","90","","4425.68","0.14","110","2","110","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","poly[[tetra-μ-2-acetato-tetraaqua-μ-oxalato-dilanthanum(III)] dihydrate]","","- C10 H24 La2 O18 -","- C10 H24 La2 O18 -","- C80 H192 La16 O144 -","8","0.25","GT3003","Koner, Rajesh; Goldberg, Israel","Two- and three-dimensional hydrated coordination polymers of diaqualanthanum(3+) ions with 2-hydroxypropanedioate, oxalate and acetate anions as bridging ligands","Acta Crystallographica Section C","2009","65","4","m160","m164","10.1107/S0108270109008798","","","0.71073","MoKα","","0.0369","0.028","","","0.0628","0.0664","","","","","","1.379","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2022531","17.9185","0.0007","18.0874","0.0008","26.5146","0.0011","90","","90","","90","","8593.4","0.6","296","","305.34","0.1","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Poly[dimethylazanium [bis(μ-pyridine-2,5-dicarboxylato)gadolinium(III)]]","","- C16 H13 Gd N3 O8 -","- C16 H13 Gd N3 O8 -","- C256 H208 Gd16 N48 O128 -","16","0.5","DG3024","Tiwari, Ranjay K.; Saini, Mukesh Kumar; Behera, Jogendra N.; Hussain, Firasat","A three-dimensional gadolinium organic framework based on a pyridinedicarboxylic acid organic linker with a paddle-wheel-type network structure","Acta Crystallographica Section C","2022","78","2","","","10.1107/S2053229622000419","","x-ray","0.71073","MoKα","","0.019","0.0175","","","0.0437","0.0445","","","","","","1.06","","","","has coordinates,has Fobs","272310","2022-01-28","02:36:56",""
"2022920","13.0134","0.0002","34.9495","0.0005","39.4864","0.0006","90","","90","","90","","17958.9","0.5","110","2","110","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","(μ-Hydrogen disulfato)-μ-oxido-bis[(4,4'-di-<i>tert</i>-butyl-2,2'-bipyridine)oxidovanadium(IV/V)] acetonitrile monosolvate","","- C38 H52 N5 O11 S2 V2 -","- C38 H52 N5 O11 S2 V2 -","- C608 H832 N80 O176 S32 V32 -","16","0.5","NX2001","Kodama, Shintaro; Hashiguchi, Terushi; Nomoto, Akihiro","Crystal structure of (μ-hydrogen di-sulfato)-μ-oxido-bis-[(4,4'-di-<i>tert</i>-butyl-2,2'-bi-pyridine)-oxidovanadium(IV/V)] aceto-nitrile monosolvate.","Acta crystallographica. Section E, Crystallographic communications","2023","79","Pt 11","1055","1058","10.1107/S2056989023009040","","","0.71073","MoKα","","0.0534","0.0431","","","0.1054","0.1101","","","","","","1.123","","","","has coordinates,has disorder,has Fobs","288148","2023-12-07","11:51:35",""
"2100521","12.1382","0.0003","10.2367","0.0002","19.5676","0.0003","90","","90","","90","","2431.37","0.09","100","","100","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","N-oxipicoline","4-methylpyridine-N-oxide","","- C6 D7 N O -","- C6 D7 N O -","- C96 D112 N16 O16 -","16","0.5","AV5052","Damay, F.; Carretero-Genevrier, A.; Cousson, A.; Rodriguez-Carvajal, J.; Van Beek, W.; Fillaux, F.","Synchrotron and neutron diffraction study of 4-methylpyridine-<i>N</i>-oxide at low temperature","Acta Crystallographica Section B","2006","62","4","627","633","10.1107/S0108768106011608","","neutron","1.2253","ConstantWavelengthNeutron","","","","","","","","","","1.93","","","","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104414","10.59801","0.0001","9.81628","0.00009","10.00739","0.00008","90","","90","","90","","1041.1","0.016","105","2","105","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","Strontium fumarate","Strontium fumarate","","- C4 H2 O4 Sr -","- C4 H2 O4 Sr -","- C32 H16 O32 Sr8 -","8","0.25","ZB5005","Ståhl, Kenny; Andersen, Jens E. T.; Shim, Irene; Christgau, Stephan","Structures of strontium diformate and strontium fumarate. A synchrotron powder diffraction study","Acta Crystallographica Section B","2009","65","4","481","487","10.1107/S0108768109023489","powder diffraction","","1.25176","synchrotron","","","","","","","","","","7.4","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2106359","6.099","","12.59","","10.163","","90","","90","","90","","780.38","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Na2 (Se O4)","","- Na2 O4 Se -","- Na2 O4 Se -","- Na16 O32 Se8 -","8","0.25","","Kalman, A.; Cruickshank, D.W.J.","A note on the structure of Na2 Se O4","Acta Crystallographica B (24,1968-38,1982)","1970","26","","436","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106591","9.402","","17.846","","5.282","","90","","90","","90","","886.257","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Co In2 -","- Co In2 -","- Co16 In32 -","16","0.5","","Stadelmaier, H.H.; Manaktala, H.K.","Intermetallic Co In2 , a representivtative of the Cu Mg2 structure type","Acta Crystallographica B (24,1968-38,1982)","1975","31","","374","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106982","6.603","","10.596","","11.485","","90","","90","","90","","803.552","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Hg2 Ge O4","","- Ge Hg2 O4 -","- Ge Hg2 O4 -","- Ge8 Hg16 O32 -","8","0.25","","Hesse, K.F.; Eysel, W.","Structure of Dimercury(II) Germanate(IV)","Acta Crystallographica B (24,1968-38,1982)","1981","37","","429","431","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107211","8.356","","10.186","","7.039","","90","","90","","90","","599.119","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","In O F","","- F In O -","- F In O -","- F16 In16 O16 -","16","0.5","","Vlasse, M.; Chamberland, B.L.; Massies, J.C.","Etude structurale de l'oxyfluorure d'indium","Acta Crystallographica B (24,1968-38,1982)","1973","29","","627","631","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2200229","7.4194","0.0012","19.044","0.003","46.943","0.007","90","","90","","90","","6632.8","1.8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Triaqua(1,10-phenanthroline-2,9-dicarboxylato)magnesium(II) dihydrate","","- C14 H16 Mg N2 O9 -","- C14 H12 Mg N2 O9 -","- C224 H192 Mg16 N32 O144 -","16","0.5","TK6009","Park, Ki-Min; Yoon, Il; Seo, Joobeom; Lee, Yoon Hee; Lee, Shim Sung","A magnesium(II) complex of 1,10-phenanthroline-2,9-dicarboxylate","Acta Crystallographica Section E","2001","57","4","m154","m156","10.1107/S1600536801004317","","","0.71073","MoKα","","0.085","0.055","","","","0.186","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202290","8.0183","0.0007","11.272","0.001","23.961","0.002","90","","90","","90","","2165.7","0.3","298","2","298","2","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Se3 Yb2 -","- Se3 Yb2 -","- Se48 Yb32 -","16","0.5","","Assoud, Abdeljalil; Kleinke, Holger","The sesquiselenide Yb~2~Se~3~","Acta Crystallographica, Section E","2003","59","","i103","i104","10.1107/S1600536803013242","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203239","24.755","0.0009","24.8832","0.0009","8.2003","0.0003","90","","90","","90","","5051.3","0.3","297","","297","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li72 Mn144 O288 -","72","2.25","","Tateishi, Kenji; Suda, Katsumi; du Boulay, Douglas; Ishizawa, Nobuo; Oishi, Shuji","LiMn~2~O~4~: a spinel-related low-temperature modification","Acta Crystallographica, Section E","2004","60","2","i18","i21","10.1107/S160053680400025X","","","0.75044","Synchrotron","","0.038","0.038","","0.038","","0.038","","","3.203","","","3.203","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203401","18.777","0.0008","23.3593","0.0013","30.4231","0.0016","90","","90","","90","","13344.1","1.2","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Poly[[dicopper(I)-tri-μ-4,4'-bipyridyl] diperchlorate dihydrate]","","- C30 H28 Cl2 Cu2 N6 O10 -","- C30 H28 Cl2 Cu2 N6 O10 -","- C480 H448 Cl32 Cu32 N96 O160 -","16","0.5","CI6346","Jian Zhang; Yao Kang; Yi-Hang Wen; Zhao-Ji Li; Ye-Yan Qin; Jian-Kai Cheng; Yuan-Gen Yao","Poly[[dicopper(I)-tri-μ-4,4'-bipyridyl] diperchlorate dihydrate]","Acta Crystallographica Section E","2004","60","4","m504","m505","10.1107/S160053680400546X","","","0.71073","MoKα","","","0.0533","","","0.1396","0.1689","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203429","8.426","0.002","12.011","0.003","15.671","0.003","90","","90","","90","","1586","0.6","100","2","100","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","dipotassium rhodizonate","","- C6 K2 O6 -","- C6 K2 O6 -","- C48 K16 O48 -","8","0.25","FL6088","Cowan, John A.; Howard, J.A.K.","Dipotassium rhodizonate","Acta Crystallographica Section E","2004","60","4","m511","m513","10.1107/S160053680400529X","","","0.71073","MoKα","","0.0459","0.038","","","0.0891","0.0928","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204110","16.612","0.009","18.311","0.009","12.598","0.007","90","","90","","90","","3832","4","295","2","295","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Di-μ-hydroxo-[(N,N,N',N'-tetramethylethylenediamine)copper(II)] dichloride","","- C12 H34 Cl2 Cu2 N4 O2 -","- C12 H34 Cl2 Cu2 N4 O2 -","- C96 H272 Cl16 Cu16 N32 O16 -","8","0.25","YA6211","Dmitry V. Albov; Dmitry V. Davydov; Vladimir V. Chernyshev","Di-μ-hydroxo-bis[(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)copper(II)] dichloride from X-ray powder data","Acta Crystallographica Section E","2004","60","8","m1193","m1195","10.1107/S1600536804018264","","","1.5406","CuKα~1~","","","","","","","","","","3.702","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204146","11.323","0.001","18.517","0.002","41.438","0.004","90","","90","","90","","8688.2","1.5","295","2","295","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","catena-Poly[[[bis(1H-imidazole-κN^3^)zinc(II)]-μ-1,4- phenylenedioxydiacetatoκ^2^O:O'] tetrahydrate]","","- C16 H24 N4 O10 Zn -","- C16 H24 N4 O10 Zn -","- C256 H384 N64 O160 Zn16 -","16","0.5","CI6422","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","<i>catena</i>-Poly[[[bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)]-μ-1,4-phenylenedioxydiacetato-κ^2^<i>O</i>:<i>O</i>'] tetrahydrate]","Acta Crystallographica Section E","2004","60","9","m1329","m1330","10.1107/S1600536804020744","","","0.71073","MoKα","","0.075","0.0634","","","0.1931","0.2031","","","","","","1.093","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206926","11.48349","0.00005","14.3208","0.00006","7.92477","0.00003","90","","90","","90","","1303.25","0.009","298","","298","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","disodium rhodizonate","Disodium 1,2,3,4-tetraoxo-5-cyclohexene-5,6-diolate","","- C6 Na2 O6 -","- C6 Na2 O6 -","- C48 Na16 O48 -","8","0.25","CV6566","Dinnebier, Robert E.; Nuss, Hanne; Jansen, Martin","Disodium rhodizonate: a powder diffraction study","Acta Crystallographica Section E","2005","61","10","m2148","m2150","10.1107/S1600536805030552","","","0.400094","","","","","","","","","","","1.3","","","","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2210260","13.52","0.003","18.127","0.004","26.501","0.005","90","","90","","90","","6495","2","292","3","292","3","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","poly[tri-μ-azido-μ-di-2-pyridyldiazene-dicopper(I,II)]","","- C10 H8 Cu2 N13 -","- C10 H8 Cu2 N13 -","- C160 H128 Cu32 N208 -","16","0.5","HG2048","Yu, Ming-Ming; Kou, Hui-Zhong; Ni, Zhong-Hai; Ge, Chun-Hua; Cui, Ai-Li","A three-dimensional polymeric mixed-valence copper complex: poly[tri-μ-azido-μ-di-2-pyridyldiazene-dicopper(I,II)]","Acta Crystallographica Section E","2006","62","9","m2050","m2051","10.1107/S1600536806028613","","","0.71073","MoKα","","0.0762","0.0735","","","0.1867","0.1887","","","","","","1.241","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212578","6.7039","0.0008","9.6251","0.0011","19.947","0.002","90","","90","","90","","1287.1","0.2","294","2","294","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","trisodium dicalcium bismuth hexaoxide","","- Bi Ca2 Na3 O6 -","- Bi Ca2 Na3 O6 -","- Bi8 Ca16 Na24 O48 -","8","0.25","HB2296","Puzdrjakova, Irina V.; Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad","Trisodium dicalcium bismuth hexaoxide","Acta Crystallographica Section E","2007","63","3","i95","i96","10.1107/S1600536807008690","","","0.71073","MoKα","","0.0179","0.0126","","","0.0305","0.0319","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213112","7.4694","0.0019","16.812","0.004","22.514","0.006","90","","90","","90","","2827.2","1.2","174","2","174","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","3,3',5,5'-Tetramethylbiphenyl-4,4'-dicarbonitrile","","- C18 H16 N2 -","- C18 H16 N2 -","- C144 H128 N16 -","8","0.25","BG2037","Britton, Doyle; Silva, Saliya A. de","3,3',5,5'-Tetramethylbiphenyl-4,4'-dicarbonitrile","Acta Crystallographica Section E","2007","63","5","o2252","o2253","10.1107/S1600536807014353","","","0.71073","MoKα","","0.052","0.044","","","0.109","0.113","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213118","6.7568","0.0009","15.732","0.002","23.364","0.003","90","","90","","90","","2483.5","0.6","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","N,N-Dimethylguanidinium chloride","","- C3 H10 Cl N3 -","- C3 H10 Cl N3 -","- C48 H160 Cl16 N48 -","16","0.5","BH2085","Weinmann, Markus; Nuss, Jürgen; Jansen, Martin","<i>N</i>,<i>N</i>-Dimethylguanidinium chloride","Acta Crystallographica Section E","2007","63","5","o2767","o2769","10.1107/S1600536807013141","","","0.71073","MoKα","","0.0424","0.0353","","","0.0808","0.0845","","","","","","1.174","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213608","13.557","0.001","15.284","0.001","33.413","0.003","90","","90","","90","","6923.3","0.9","295","2","295","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","catena-Poly[[silver(I)-μ-1,2-di-4-pyridylethane-κ^2^N:N'] hemifumarate 4.5-hydrate]","","- C28 H44 Ag2 N4 O13 -","- C28 H44 Ag2 N4 O13 -","- C224 H352 Ag16 N32 O104 -","8","0.25","XU2221","Yan, Guo-Bing; Ng, Seik Weng","<i>catena</i>-Poly[bis[silver(I)-μ-1,2-di-4-pyridylethane-κ^2^<i>N</i>:<i>N</i>'] fumarate nonahydrate]","Acta Crystallographica Section E","2007","63","5","m1368","m1369","10.1107/S1600536807017187","","","0.71073","MoKα","","0.05","0.035","","","0.097","0.107","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215231","9.4452","0.0007","10.0151","0.0007","32.566","0.002","90","","90","","90","","3080.6","0.4","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Tetraaqualithium(I) bis(tropolonato-κ^2^O,O')lithate(I)","","- C14 H18 Li2 O8 -","- C14 H18 Li2 O8 -","- C112 H144 Li16 O64 -","8","0.25","NG2307","Steyl, Gideon","Tetraaqualithium(I) bis(tropolonato-κ^2^<i>O</i>,<i>O</i>')lithate(I)","Acta Crystallographica Section E","2007","63","9","m2343","m2343","10.1107/S1600536807039657","","","0.71073","MoKα","","0.0635","0.0549","","","0.1427","0.1567","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2218789","5.394","0.0011","12.691","0.003","15.399","0.003","90","","90","","90","","1054.1","0.4","290","","290","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","catena-poly[[diaquamagnesium(II)]-μ-oxalato]","","- C2 H4 Mg O6 -","- C2 H4 Mg O6 -","- C16 H32 Mg8 O48 -","8","0.25","PV2083","Chen, Xue-An; Song, Fang-Ping; Chang, Xin-An; Zang, He-Gui; Xiao, Wei-Qiang","A new polymorph of magnesium oxalate dihydrate","Acta Crystallographica Section E","2008","64","7","m863","","10.1107/S1600536808015870","","","0.71073","MoKα","","0.0616","0.0342","","","0.1048","0.1096","","","","","","0.966","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2219045","9.831","0.002","13.609","0.003","24.344","0.005","90","","90","","90","","3257","1.2","120","2","120","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","(2<i>Z</i>,3<i>Z</i>)-Quinoxaline-2,3(1<i>H</i>,4H)-dione dioxime","","- C8 H8 N4 O2 -","- C8 H8 N4 O2 -","- C128 H128 N64 O32 -","16","0.5","HK2493","Kakanejadifard, Ali; Amani, Vahid","(2<i>Z</i>,3<i>Z</i>)-Quinoxaline-2,3(1<i>H</i>,4<i>H</i>)-dione dioxime","Acta Crystallographica Section E","2008","64","8","o1512","","10.1107/S1600536808021570","","","0.71073","MoKα","","0.0767","0.0598","","","0.1109","0.1176","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2225526","7.4093","0.0005","18.9267","0.0017","46.609","0.004","90","","90","","90","","6536.1","0.9","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Triaqua(1,10-phenanthroline-2,9-dicarboxylato)cobalt(II) dihydrate","","- C14 H16 Co N2 O9 -","- C14 H16 Co N2 O9 -","- C224 H256 Co16 N32 O144 -","16","0.5","HG2639","Shi, Zi-Fa; Gao, Zhu-Qing; Gu, Jin-Zhong","Triaqua(1,10-phenanthroline-2,9-dicarboxylato)cobalt(II) dihydrate","Acta Crystallographica Section E","2010","66","4","m372","m373","10.1107/S1600536810007567","","","0.71073","MoKα","","0.0462","0.035","","","0.0914","0.0981","","","","","","1.056","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2228407","10.4382","0.0016","27.896","0.004","30.089","0.005","90","","90","","90","","8761","2","298","2","298","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","Bis(μ-bis{[4-(2-pyridyl)pyrimidin-2-yl]sulfanyl}methane)disilver(I) bis(perchlorate)","","- C38 H28 Ag2 Cl2 N12 O8 S4 -","- C38 H28 Ag2 Cl2 N12 O8 S4 -","- C304 H224 Ag16 Cl16 N96 O64 S32 -","8","0.25","HY2383","Zhu, Hai-Bin","Bis(μ-bis{[4-(2-pyridyl)pyrimidin-2-yl]sulfanyl}methane)disilver(I) bis(perchlorate)","Acta Crystallographica Section E","2010","66","12","m1691","","10.1107/S160053681004924X","","","0.71073","MoKα","","0.0858","0.0458","","","0.1393","0.1718","","","","","","1.052","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2229017","18.057","0.002","18.792","0.002","30.07","0.004","90","","90","","90","","10204","2","298","2","298","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Bis[2-(cyclopentyliminomethyl)-4-nitrophenolato- κ^2^<i>N</i>^2^,<i>O</i>]cobalt(II)","","- C24 H26 Co N4 O6 -","- C24 H26 Co N4 O6 -","- C384 H416 Co16 N64 O96 -","16","0.5","CV5039","Xu, Mai; Wei, Yi-Jun; Wang, Feng-Wu","Bis[2-(cyclopentyliminomethyl)-4-nitrophenolato-κ^2^<i>N</i>^2^,<i>O</i>]cobalt(II)","Acta Crystallographica Section E","2011","67","2","m245","","10.1107/S1600536811002194","","","0.71073","MoKα","","0.1213","0.0543","","","0.1499","0.1816","","","","","","0.916","","","","has coordinates,has disorder,has Fobs","176789","2020-10-21","18:00:00",""
"2233956","12.0713","0.0009","23.4762","0.001","34.496","0.002","90","","90","","90","","9775.8","1","173","2","173","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","2,2'-[(2<i>S</i>*,6<i>R</i>*)-Piperidine-2,6-diyl]dipropan-2-ol","","- C11 H23 N O2 -","- C11 H23 N O2 -","- C352 H736 N32 O64 -","32","1","PK2389","Journot, Guillaume; Neier, Reinhard; Stoeckli-Evans, Helen","2,2'-[(2<i>S</i>*,6<i>R</i>*)-Piperidine-2,6-diyl]dipropan-2-ol","Acta Crystallographica Section E","2012","68","3","o857","","10.1107/S1600536812005879","","","0.71073","MoKα","","0.1441","0.0856","","","0.1284","0.1462","","","","","","1.163","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237157","9.6016","0.0019","15.701","0.003","26.722","0.005","90","","90","","90","","4028.5","1.3","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Poly[[tetraaquadi-μ~4~-fumarato-μ~2~-oxalato-dierbium(III)] tetrahydrate]","","- C10 H20 Er2 O20 -","- C10 H20 Er2 O20 -","- C80 H160 Er16 O160 -","8","0.25","HG5272","Yang, Qing-Feng; Wang, Xiao-Zhong; Xue, Ping","Poly[[tetraaquadi-μ~4~-fumarato-μ~2~-oxalato-dierbium(III)] tetrahydrate]","Acta Crystallographica Section E","2013","69","1","m52","","10.1107/S160053681205026X","","","0.71073","MoKα","","0.0204","0.0182","","","0.0443","0.0453","","","","","","1.108","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237340","16.83","0.004","22.032","0.005","23.221","0.005","90","","90","","90","","8610","3","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","<i>trans</i>-Dibromidotetrakis(pyridine-κ<i>N</i>)ruthenium(II)","","- C20 H20 Br2 N4 Ru -","- C20 H20 Br2 N4 Ru -","- C320 H320 Br32 N64 Ru16 -","16","0.5","HY2613","Wu, Xiu-Li; Ye, Ru-Fei; Jia, Ai-Quan; Chen, Qun; Zhang, Qian-Feng","<i>trans</i>-Dibromidotetrakis(pyridine-κ<i>N</i>)ruthenium(II)","Acta Crystallographica Section E","2013","69","2","m105","","10.1107/S1600536813000871","","","0.71073","MoKα","","0.0493","0.0251","","","0.0588","0.0686","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237835","19.6446","0.0004","21.5251","0.0004","22.9585","0.0004","90","","90","","90","","9708","0.3","193","2","193","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","(4-Ethoxybenzoyl)[8-(4-ethoxybenzoyl)-2,7-dimethoxynaphthalen-1-yl]methanone","","- C30 H28 O6 -","- C30 H28 O6 -","- C480 H448 O96 -","16","0.5","GK2562","Sasagawa, Kosuke; Sakamoto, Rei; Hijikata, Daichi; Yonezawa, Noriyuki; Okamoto, Akiko","(4-Ethoxybenzoyl)[8-(4-ethoxybenzoyl)-2,7-dimethoxynaphthalen-1-yl]methanone","Acta Crystallographica Section E","2013","69","5","o651","","10.1107/S1600536813008581","","","1.54187","CuKα","","0.0421","0.041","","","0.0976","0.0986","","","","","","1.148","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2240592","14.304","0.009","11.688","0.007","7.2857","0.0004","90","","90","","90","","1218.1","1.1","298","","298","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","Barium_perchlorate_anhydrate","Barium perchlorate anhydrate","","- Ba Cl2 O8 -","- Ba Cl2 O8 -","- Ba8 Cl16 O64 -","8","0.25","CV5487","Lee, Jeonghoo H.; Kang, Ji Hoon; Lim, Sung-Chul; Hong, Seung-Tae","Crystal structure of barium perchlorate anhydrate, Ba(ClO~4~)~2~, from laboratory X-ray powder data","Acta Crystallographica Section E","2015","71","6","588","591","10.1107/S2056989015008828","powder diffraction","","1.54059","CuKα~1~","","","","","","","","","","1.33","","","","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2244009","7.2131","0.0002","13.8648","0.0005","53.4532","0.0018","90","","90","","90","","5345.8","0.3","100","","100","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","2-(4-Methylphenyl)-1<i>H</i>-perimidine hemihydrate","","- C18 H15 N2 O0.5 -","- C18 H15 N2 O0.5 -","- C288 H240 N32 O8 -","16","0.5","WM5631","Kalle, Paulina; Tatarin, Sergei V.; Kiseleva, Marina A.; Zakharov, Alexander Yu.; Smirnov, Daniil E.; Bezzubov, Stanislav I.","Syntheses and crystal structures of 2-(<i>p</i>-tolyl)-1<i>H</i>-perimidine hemihydrate and 1-methyl-2-(<i>p</i>-tolyl)-1<i>H</i>-perimidine","Acta Crystallographica Section E","2022","78","2","","","10.1107/S2056989022000287","","x-ray","0.71073","MoKα","","0.0668","0.0492","","","0.1284","0.14","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","272052","2022-01-15","02:36:25",""
"2310101","14.57","","7.32","","4.22","","90","","90","","90","","450.073","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Fe1.1 Cr0.9 B0.9","","- B0.9 Cr0.9 Fe1.1 -","- B0.9 Cr0.9 Fe1.1 -","- B14.4 Cr14.4 Fe17.6 -","16","0.5","","Brown, B.E.; Beerntsen, D.J.","Refinement of an iron chromium boride with the Mn4 B structure","Acta Crystallographica (1,1948-23,1967)","1964","17","","448","450","10.1107/S0365110X64001001","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2310804","10.437","","12.845","","24.369","","90","","90","","90","","3266.99","","","","","","","","","","","","","1","F d d d :2","-F 2uv 2vw","70","","","","- S8 -","- S8 -","- S128 -","16","0.5","","Abrahams, S.C.","The crystal and molecular structure of orthorhombic sulphur","Acta Crystallographica (1,1948-23,1967)","1955","8","","661","671","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"3500054","8.55706","0.00016","5.8935","0.0002","17.7013","0.0007","90","","90","","90","","892.69","0.05","295","","295","","","","","","","","Solid state synthesis traces of MgO as impurity","4","F d d d :2","-F 2uv 2vw","70","","","","- Li3 Mg2 Nb O6 -","- Li2.997 Mg2.003 Nb O6 -","- Li23.976 Mg16.024 Nb8 O48 -","8","0.25","","Armel Le Bail","A 1995 neutron/X-ray study of Li3Mg2NbO6 stopped because of Mather et al., J. Mater Chem. 1995, 5, 1177-1182","Personal communication to COD","2016","","","","","","powder diffraction","","1.5938","ConstantWavelengthNeutronDiffraction","","","","","","","","","3.5839","","","","","","","","has coordinates","188881","2020-10-21","18:00:00",""
"3500055","8.55816","0.00012","5.90289","0.00009","17.7437","0.0003","90","","90","","90","","896.37","0.02","295","","295","","","","","","","","Solid state synthesis traces of MgO as impurity","4","F d d d :2","-F 2uv 2vw","70","","","","- Li3 Mg2 Nb O6 -","- Li2.967 Mg2.041 Nb O6 -","- Li23.736 Mg16.328 Nb8 O48 -","8","0.25","","Armel Le Bail","A 1995 neutron/X-ray study of Li3Mg2NbO6 stopped because of Mather et al., J. Mater Chem. 1995, 5, 1177-1182","Personal communication to COD","2016","","","","","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","3.6603","","","","","","","","has coordinates","188882","2020-10-21","18:00:00",""
"4000644","8.7433","0.0005","20.7448","0.0011","34.3664","0.0018","90","","90","","90","","6233.3","0.6","275","2","275","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","Perles, Josefina; Iglesias, Marta; Martín-Luengo, Maria-Ángeles; Monge, M. Ángeles; Ruiz-Valero, Caridad; Snejko, Natalia","Metal−Organic Scandium Framework: Useful Material for Hydrogen Storage and Catalysis","Chemistry of Materials","2005","17","23","5837","5842","10.1021/cm051362e","","","","","","","","","","","","","","","","","","","","","has coordinates","192410","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",""
"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",""
"4001939","17.2988","0.0015","18.119","0.0016","31.676","0.003","90","","90","","90","","9928.4","1.5","150","2","150","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C7 H7 In N3 O9.5 -","- C7 H7 In N3 O9.5 -","- C224 H224 In32 N96 O304 -","32","1","","Zhao, Xiang; Mao, Chengyu; Bu, Xianhui; Feng, Pingyun","Direct Observation of Two Types of Proton Conduction Tunnels Coexisting in a New Porous Indium‒Organic Framework","Chemistry of Materials","2014","26","8","2492","","10.1021/cm500473f","","","0.71073","MoKα","","0.0321","0.0239","","","0.0612","0.0651","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002643","12.638","0.015","9.321","0.01","9.205","0.017","90","","90","","90","","1084","3","295","","295","","","","11800000","","","","","3","F d d d :2","-F 2uv 2vw","70","δ'-manganese borohydride","manganese ditetrahydroborate","","- B2 H8 Mn -","- B2 H8 Mn -","- B32 H128 Mn16 -","16","0.5","","Tumanov, Nikolay A.; Roedern, Elsa; Łodziana, Zbigniew; Nielsen, Dorrit B.; Jensen, Torben R.; Talyzin, Alexandr V.; Černý, Radovan; Chernyshov, Dmitry; Dmitriev, Vladimir; Palasyuk, Taras; Filinchuk, Yaroslav","High-Pressure Study of Mn(BH4)2Reveals a Stable Polymorph with High Hydrogen Density","Chemistry of Materials","2016","28","1","274","","10.1021/acs.chemmater.5b04102","powder diffraction","","0.7092","synchrotron","","","","","","","","","10.6194","53.85","","","","","","","has coordinates","270525","2021-11-08","17:37:12",""
"4003191","8.7442","0.0006","20.7536","0.0014","34.333","0.002","90","","90","","90","","6230.5","0.7","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.1568","0.124","","0.3313","0.3159","0.3313","","","","","","1.0478","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003192","8.777","0.006","20.772","0.014","34.38","0.02","90","","90","","90","","6268","7","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.1027","0.0545","","0.1315","0.1115","0.1315","","","","","","0.9012","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003193","8.681","0.004","20.723","0.007","34.341","0.013","90","","90","","90","","6178","4","293","","293","","","","200000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 O12 Sc2 -","- C24 H12 O12 Sc2 -","- C192 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.1792","0.1578","","0.336","0.3206","0.336","","","","","","1.4507","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003194","8.7561","0.0013","20.752","0.002","34.297","0.005","90","","90","","90","","6232","1.4","293","","293","","","","200000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C25.8 H12 O12 Sc2 -","- C25.8 H12 O12 Sc2 -","- C206.4 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.0893","0.0593","","0.1465","0.1258","0.1465","","","","","","0.9276","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003195","8.7373","0.0015","20.691","0.002","34.124","0.006","90","","90","","90","","6169.1","1.6","293","","293","","","","400000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C30 H12 O12 Sc2 -","- C30 H12 O12 Sc2 -","- C240 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.0942","0.0744","","0.1741","0.1658","0.1741","","","","","","1.0247","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003196","8.7185","0.0007","20.7142","0.0008","34.265","0.0017","90","","90","","90","","6188.1","0.6","293","","293","","","","400000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C29 H12 O12 Sc2 -","- C29 H12 O12 Sc2 -","- C232 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.0933","0.0605","","0.1822","0.1472","0.1822","","","","","","0.8477","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003197","8.7578","0.0009","20.7293","0.0011","34.292","0.003","90","","90","","90","","6225.5","0.9","293","","293","","","","200000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 O12 Sc2 -","- C24 H12 O12 Sc2 -","- C192 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.0742","0.0523","","0.1222","0.1141","0.1222","","","","","","1.0082","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003198","8.7745","0.0015","20.668","0.002","34.203","0.005","90","","90","","90","","6202.8","1.5","293","","293","","","","500000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C30 H12 O12 Sc2 -","- C30 H12 O12 Sc2 -","- C240 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.1108","0.079","","0.1831","0.1599","0.1831","","","","","","1.0668","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003199","8.6945","0.0019","20.808","0.002","34.079","0.004","90","","90","","90","","6165.4","1.6","293","","293","","","","300000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C30 H12 O12 Sc2 -","- C30 H12 O12 Sc2 -","- C240 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.0992","0.0688","","0.1844","0.1628","0.1844","","","","","","0.9973","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003200","8.6945","0.0019","20.808","0.002","34.079","0.004","90","","90","","90","","6165.4","1.6","293","","293","","","","700000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C30 H12 O12 Sc2 -","- C30 H12 O12 Sc2 -","- C240 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.092","0.0643","","0.1377","0.1222","0.1377","","","","","","0.954","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003201","8.779","0.003","20.742","0.003","34.287","0.007","90","","90","","90","","6243","3","293","","293","","","","200000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C28.5 H12 O12 Sc2 -","- C28.5 H12 O12 Sc2 -","- C228 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.0973","0.0579","","0.1602","0.1284","0.1602","","","","","","0.8839","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003202","8.779","0.003","20.742","0.003","34.287","0.007","90","","90","","90","","6243","3","293","","293","","","","500000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C30 H12 O12 Sc2 -","- C30 H12 O12 Sc2 -","- C240 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.1108","0.0774","","0.1447","0.1292","0.1447","","","","","","1.0493","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003203","8.779","0.003","20.742","0.003","34.287","0.007","90","","90","","90","","6243","3","293","","293","","","","800000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C30 H12 O12 Sc2 -","- C30 H12 O12 Sc2 -","- C240 H96 O96 Sc16 -","8","0.25","","McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A.","Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules","Chemistry of Materials","2016","28","2","466","","10.1021/acs.chemmater.5b02891","","x-ray","0.71073","MoKα","","0.0999","0.0722","","0.1467","0.127","0.1467","","","","","","1.1091","","","","has coordinates","231424","2020-10-21","18:00:00",""
"4003633","18.2924","0.0007","23.5585","0.0008","59.258","0.002","90","","90","","90","","25536.7","1.6","170","2","170.02","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C72 H78 F6 O8 Sb -","- C72 H78 F6 O8 Sb -","- C1152 H1248 F96 O128 Sb16 -","16","0.5","","Guo, Jing; Zhou, Cong; Xie, Sheng; Luo, Shenglian; Gopalakrishna, Tullimilli Y.; Sun, Zhe; Jouha, Jabrane; Wu, Jishan; Zeng, Zebing","Large Aromatic Hydrocarbon Radical Cation with Global Aromaticity and State-Associated Magnetic Activity","Chemistry of Materials","2020","32","14","5927","5936","10.1021/acs.chemmater.9b05099","","","1.34139","GaKα","","0.1524","0.0876","","","0.2448","0.2937","","","","","","1.024","","","","has coordinates","257103","2020-10-21","18:00:00",""
"4003835","18.2533","0.0014","32.815","0.003","32.965","0.003","90","","90","","90","","19745","3","100","","100","","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C7.25 H11.5 Cl0.5 F3 K N O3 S -","- C7.25 H11.5 Cl0.5 F3 K N O3 S -","- C464 H736 Cl32 F192 K64 N64 O192 S64 -","64","2","","Schkeryantz, Luke A.; Zheng, Jingfeng; McCulloch, William D.; Qin, Lei; Zhang, Songwei; Moore, Curtis E.; Wu, Yiying","Designing Potassium Battery Salts through a Solvent-in-Anion Concept for Concentrated Electrolytes and Mimicking Solvation Structures","Chemistry of Materials","2020","32","24","10423","10434","10.1021/acs.chemmater.0c02983","","","0.71073","MoKα","","0.0639","0.0392","","","0.094","0.1061","","","","","","1.047","","","","has coordinates,has disorder","260418","2021-01-04","03:07:43",""
"4022410","17.009","0.002","27.519","0.003","8.5","0.002","90","","90","","90","","3978.5","1","243.2","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","cis,cis-[1.1](3,3')-Azobenzenophane","","","- C26 H20 N4 -","- C26 H20 N4 -","- C208 H160 N32 -","8","0.25","","Yasuo Norikane; Kogorou Kitamoto; Nobuyuki Tamaoki","Novel Crystal Structure, Cis-Trans Isomerization, and Host Property of Meta-Substituted Macrocyclic Azobenzenes with the Shortest Linkers","Journal of Organic Chemistry","2003","68","","8291","8304","10.1021/jo0341160","","","0.7107","MoKα","","","0.0383","","","","0.1206","","","","","","1.224","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022550","12.707","0.004","13.653","0.002","19.07","0.02","90","","90","","90","","3308","4","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C16 H20 O8 -","- C16 H20 O8 -","- C128 H160 O64 -","8","0.25","","Carles Ayats; Pelayo Camps; María D. Duque; Mercé Font-Bardia; M. Rosa Muñoz; Xavier Solans; Santiago Vázquez","Alternative Syntheses of the New D~2d~ Symmetric Tetramethyl Tricyclo- [3.3.0.0^3,7^]octane-1,3,5,7-tetracarboxylate","Journal of Organic Chemistry","2003","68","","8715","8718","10.1021/jo035062x","","","0.71069","MoKα","","0.1246","0.0509","","","0.1212","0.1477","","","","","","0.994","","","","has coordinates","178404","2020-10-21","18:00:00",""
"4027803","5.9468","","14.09","","24.605","","90","","90","","90","","2061.66","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs2 (Ag Nb S4)","","- Ag Cs2 Nb S4 -","- Ag Cs2 Nb S4 -","- Ag8 Cs16 Nb8 S32 -","8","0.25","","Klepp, K.O.; Gabl, G.","New complex sulfides of the heavy Va-metals with pseudo-onedimensional structures: preparation and structural characterization of K2 Ag Nb S4, Cs2 Ag Nb S4, K2 Ag Ta S4, Rb2 Ag Ta S4 and Cs2 Ag Ta S4","European Journal of Solid State Inorganic Chemistry","1997","34","","1119","1131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4027804","5.976","","14.098","","24.61","","90","","90","","90","","2073.38","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Cs2 (Ag Ta S4)","","- Ag Cs2 S4 Ta -","- Ag Cs2 S4 Ta -","- Ag8 Cs16 S32 Ta8 -","8","0.25","","Gabl, G.; Klepp, K.O.","New complex sulfides of the heavy Va-metals with pseudo-onedimensional structures: preparation and structural characterization of K2 Ag Nb S4, Cs2 Ag Nb S4, K2 Ag Ta S4, Rb2 Ag Ta S4 and Cs2 Ag Ta S4","European Journal of Solid State Inorganic Chemistry","1997","34","","1119","1131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4027809","5.913","","13.201","","22.645","","90","","90","","90","","1767.61","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K2 (Ag Nb S4)","","- Ag K2 Nb S4 -","- Ag K2 Nb S4 -","- Ag8 K16 Nb8 S32 -","8","0.25","","Klepp, K.O.; Gabl, G.","New complex sulfides of the heavy Va-metals with pseudo-onedimensional structures: preparation and structural characterization of K2 Ag Nb S4, Cs2 Ag Nb S4, K2 Ag Ta S4, Rb2 Ag Ta S4 and Cs2 Ag Ta S4","European Journal of Solid State Inorganic Chemistry","1997","34","","1119","1131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4027810","5.929","","13.197","","22.645","","90","","90","","90","","1771.86","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K2 (Ag Ta S4)","","- Ag K2 S4 Ta -","- Ag K2 S4 Ta -","- Ag8 K16 S32 Ta8 -","8","0.25","","Klepp, K.O.; Gabl, G.","New complex sulfides of the heavy Va-metals with pseudo-onedimensional structures: preparation and structural characterization of K2 Ag Nb S4, Cs2 Ag Nb S4, K2 Ag Ta S4, Rb2 Ag Ta S4 and Cs2 Ag Ta S4","European Journal of Solid State Inorganic Chemistry","1997","34","","1119","1131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4027811","5.953","","13.56","","23.5","","90","","90","","90","","1896.98","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 (Ag Ta S4)","","- Ag Rb2 S4 Ta -","- Ag Rb2 S4 Ta -","- Ag8 Rb16 S32 Ta8 -","8","0.25","","Gabl, G.; Klepp, K.O.","New complex sulfides of the heavy Va-metals with pseudo-onedimensional structures: preparation and structural characterization of K2 Ag Nb S4, Cs2 Ag Nb S4, K2 Ag Ta S4, Rb2 Ag Ta S4 and Cs2 Ag Ta S4","European Journal of Solid State Inorganic Chemistry","1997","34","","1119","1131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030505","5.735","0.003","13.481","0.007","23.941","0.012","90","","90","","90","","1851","1.6","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Cu K2 Se4 Ta -","- Cu K2 Se4 Ta -","- Cu8 K16 Se32 Ta8 -","8","0.25","","Lu, Y.-J.; Wu, P.; Ibers, J. A.","Synthesis of the new one-dimensional quaternary compound K2CuTaSe4 and its structural relationship to other compounds in the K/Cu/M/Q (M = Nb, Ta; Q = S, Se) system","European Journal of Solid State and Inorganic Chemistry","1993","30","","101","110","","","x-ray","0.7093","MoKα","","","0.067","","","","","","0.131","","","","","","","","has coordinates","178484","2020-10-21","18:00:00",""
"4030801","8.98","0.004","22.91","0.02","43.61","0.03","90","","90","","90","","8972","11","","","293","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- Cs0.64 I16 La9 N4 Na0.36 -","- Cs0.64 I16 La9 N4 Na0.36 -","- Cs5.12 I128 La72 N32 Na2.88 -","8","0.25","","Lulei, M.; Corbett, J. D.","A new rare-earth-metal nitride halide with unusual structural features: CsxNa(1-x)La9I16N4 - with a remark about the stoichiometric compounds ALa9I16N4 (A = Na, Rb, Cs)","European Journal of Solid State and Inorganic Chemistry","1996","33","","241","250","","","x-ray","0.71073","MoKα","","","0.023","","","0.031","","","","","","","","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4030899","5.448","0.001","13.31","0.002","23.431","0.004","90","","90","","90","","1699","0.5","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Cu Rb2 S4 V -","- Cu Rb2 S4 V -","- Cu8 Rb16 S32 V8 -","8","0.25","","Rumpf, C.; Tillinski, R.; Nather, C.; Durichen, P.; Jeb, I.; Bensch, W.","Synthesis, crystal structures and optical properties of new quaternary chalcogenides of Va metals : Rb2CuVS4, K2CuVSe4, Rb2CuNbSe4, Cs2CuNbSe4 and Rb2CuNbS4","European Journal of Solid State and Inorganic Chemistry","1997","34","","1187","1198","","","x-ray","0.71073","MoKα","","","0.0217","","","0.046","","","","","","","1.004","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4030900","5.6312","0.0009","13.264","0.002","23.468","0.003","90","","90","","90","","1752.9","0.4","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Cu K2 Se4 V -","- Cu K2 Se4 V -","- Cu8 K16 Se32 V8 -","8","0.25","","Rumpf, C.; Tillinski, R.; Nather, C.; Durichen, P.; Jeb, I.; Bensch, W.","Synthesis, crystal structures and optical properties of new quaternary chalcogenides of Va metals : Rb2CuVS4, K2CuVSe4, Rb2CuNbSe4, Cs2CuNbSe4 and Rb2CuNbS4","European Journal of Solid State and Inorganic Chemistry","1997","34","","1187","1198","","","x-ray","0.71073","MoKα","","","0.0182","","","0.0431","","","","","","","1.025","","","","has coordinates","178488","2020-10-21","18:00:00",""
"4030901","5.5924","0.0007","13.498","0.002","23.839","0.003","90","","90","","90","","1799.5","0.4","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Cu Nb Rb2 S4 -","- Cu Nb Rb2 S4 -","- Cu8 Nb8 Rb16 S32 -","8","0.25","","Rumpf, C.; Tillinski, R.; Nather, C.; Durichen, P.; Jeb, I.; Bensch, W.","Synthesis, crystal structures and optical properties of new quaternary chalcogenides of Va metals : Rb2CuVS4, K2CuVSe4, Rb2CuNbSe4, Cs2CuNbSe4 and Rb2CuNbS4","European Journal of Solid State and Inorganic Chemistry","1997","34","","1187","1198","","","x-ray","0.71073","MoKα","","","0.0231","","","0.0513","","","","","","","0.964","","","","has coordinates","178488","2020-10-21","18:00:00",""
"4030902","5.7796","0.0003","13.887","0.002","24.609","0.002","90","","90","","90","","1975.2","0.3","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Cu Nb Rb2 Se4 -","- Cu Nb Rb2 Se4 -","- Cu8 Nb8 Rb16 Se32 -","8","0.25","","Rumpf, C.; Tillinski, R.; Nather, C.; Durichen, P.; Jeb, I.; Bensch, W.","Synthesis, crystal structures and optical properties of new quaternary chalcogenides of Va metals : Rb2CuVS4, K2CuVSe4, Rb2CuNbSe4, Cs2CuNbSe4 and Rb2CuNbS4","European Journal of Solid State and Inorganic Chemistry","1997","34","","1187","1198","","","x-ray","0.71073","MoKα","","","0.0194","","","0.0399","","","","","","","1.005","","","","has coordinates","178488","2020-10-21","18:00:00",""
"4030903","5.8041","0.0005","14.486","0.002","25.418","0.002","90","","90","","90","","2137.1","0.4","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Cs2 Cu Nb Se4 -","- Cs2 Cu Nb Se4 -","- Cs16 Cu8 Nb8 Se32 -","8","0.25","","Rumpf, C.; Tillinski, R.; Nather, C.; Durichen, P.; Jeb, I.; Bensch, W.","Synthesis, crystal structures and optical properties of new quaternary chalcogenides of Va metals : Rb2CuVS4, K2CuVSe4, Rb2CuNbSe4, Cs2CuNbSe4 and Rb2CuNbS4","European Journal of Solid State and Inorganic Chemistry","1997","34","","1187","1198","","","x-ray","0.71073","MoKα","","","0.0246","","","0.0675","","","","","","","0.973","","","","has coordinates","178488","2020-10-21","18:00:00",""
"4031777","28.8","","38.143","","32.005","","90","","90","","90","","35158.1","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K14 ((H2 O) W19 P2 O69) (H2 O)24","","- K7 O92 P2 W19 -","- K7 O92 P2 W19 -","- K112 O1472 P32 W304 -","16","0.5","","Tourne, C.M.; Tourne, G.F.","Aquanonadecatungstodiphosphate(14-) polyanion, (P2W19 O69(OH2))(14-): X-ray crystallographic structure of its potassium salt, chemical relationships and conversion","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1988","1988","","2411","2420","","","","","","","","","","","","","","","","","","","","","","has coordinates","172274","2020-10-21","18:00:00",""
"4036946","14.4383","0.0004","16.5487","0.0006","31.6999","0.0008","90","","90","","90","","7574.2","0.4","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C22 H24 N2 O2 -","- C22 H24 N2 O2 -","- C352 H384 N32 O32 -","16","0.5","","Jia, Wen-Liang; He, Jian; Yang, Jia-Jing; Gao, Xue-Wang; Liu, Qiang; Wu, Li-Zhu","Homocoupling of 3-Halooxindole via Visible-Light Photocatalysis: A Mild Access to 3,3'-Bioxindoles.","The Journal of organic chemistry","2016","81","16","7172","7181","10.1021/acs.joc.6b01045","","","0.71073","MoKα","","0.0726","0.0535","","","0.1355","0.1488","","","","","","1.107","","","","has coordinates","235463","2020-10-21","18:00:00",""
"4062373","11.7836","0.0001","35.3745","0.0001","51.5251","0.0006","90","","90","","90","","21477.7","0.3","295","2","295","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C37 H42 Cr4 N2 O20 Te2 -","- C37 H42 Cr4 N2 O20 Te2 -","- C592 H672 Cr64 N32 O320 Te32 -","16","0.5","","Shieh, Minghuey; Ho, Li-Fang; Guo, Yu-Wen; Lin, Shu-Fen; Lin, Yi-Chun; Peng, Shie-Ming; Liu, Yi-Hung","Carbonylchromium Monotelluride Complexes [Et~4~N]~2~[Te{Cr(CO)~5~}~n~] (n = 2, 3): Two Important Intermediates","Organometallics","2003","22","24","5020","5026","10.1021/om034033+","","","","","","","0.0261","","","0.0706","","","","","","","","","","","has coordinates","192151","2020-10-21","18:00:00",""
"4062488","20.901","0.005","28.919","0.006","50.135","0.011","90","","90","","90","","30303","19","150","2","150","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C74 H110 Cl Mg2 N2 O5 P2 Ti -","- C74 H98 Cl Mg2 N2 O5 P2 Ti -","- C1184 H1568 Cl16 Mg32 N32 O80 P32 Ti16 -","16","0.5","","Mokuolu, Q. Folashade; Duckmanton, Paul A.; Blake, Alexander J.; Wilson, Claire; Love, Jason B.","Non-cyclopentadienyl Titanium(III)-Magnesium Hydride Formation by Reduction of an Amidotitanium(IV) Complex","Organometallics","2003","22","22","4387","4389","10.1021/om034164a","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","192091","2020-10-21","18:00:00",""
"4065855","11.5251","0.0009","24.5644","0.0019","42.952","0.003","90","","90","","90","","12160","1.6","100","2","100","2","","","","","","","","9","F d d d :2","-F 2uv 2vw","70","1318 trans-[Fe(PNP-iPr)(CO)2Br]BF4.(C2H5)2O","(N,N'-bis(di-isopropylphosphino)-2,6-diaminopyridine)- -trans-bis(carbonyl)-bromo-iron(II) tetrafluoroborate diethylether solvate","","- C23 H43 B Br F4 Fe N3 O3 P2 -","- C23 H43 B Br F4 Fe N3 O3 P2 -","- C368 H688 B16 Br16 F64 Fe16 N48 O48 P32 -","16","0.5","","Benito-Garagorri, David; Alves, Luis Gonçalo; Veiros, Luis F.; Standfest-Hauser, Christina M.; Tanaka, Shinji; Mereiter, Kurt; Kirchner, Karl","Kinetically Controlled Formation of Octahedraltrans-Dicarbonyl Iron(II) PNP Pincer Complexes: The Decisive Role of Spin-State Changes§","Organometallics","2010","29","21","4932","","10.1021/om1001638","","","0.71073","MoKα","","0.0493","0.0423","","","0.1055","0.1099","","","","","","1.093","","","","has coordinates","178551","2020-10-21","18:00:00",""
"4072193","17.865","0.0005","24.3175","0.0007","27.4188","0.0007","90","","90","","90","","11911.6","0.6","123","2","123","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C56 H84 Li2 N4 O4 Zn -","- C56 H84 Li2 N4 O4 Zn -","- C448 H672 Li16 N32 O32 Zn8 -","8","0.25","","Armstrong, David R.; Drummond, Allison M.; Balloch, Liam; Graham, David V.; Hevia, Eva; Kennedy, Alan R.","Metalation of 2,4,6-Trimethylacetophenone Using Organozinc Reagents: The Role of the Base in Determining Composition and Structure of the Developing Enolate","Organometallics","2008","27","22","5860","","10.1021/om800658s","","","0.71073","MoKα","","0.0507","0.0342","","","0.074","0.0804","","","","","","1.061","","","","has coordinates","178610","2020-10-21","18:00:00",""
"4072194","20.948","0.005","20.964","0.005","27.849","0.008","90","","90","","90","","12230","5","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C62 H90 Li2 N2 O4 Zn -","- C62 H90 Li2 N2 O4 Zn -","- C496 H720 Li16 N16 O32 Zn8 -","8","0.25","","Armstrong, David R.; Drummond, Allison M.; Balloch, Liam; Graham, David V.; Hevia, Eva; Kennedy, Alan R.","Metalation of 2,4,6-Trimethylacetophenone Using Organozinc Reagents: The Role of the Base in Determining Composition and Structure of the Developing Enolate","Organometallics","2008","27","22","5860","","10.1021/om800658s","","","0.71073","MoKα","","0.0627","0.0454","","","0.1135","0.1186","","","","","","0.982","","","","has coordinates,has disorder","178610","2020-10-21","18:00:00",""
"4073255","24.495","0.004","25.713","0.004","43.627","0.01","90","","90","","90","","27478","9","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C57 H59 Cl3 N2 P4 Ru -","- C57 H59 Cl3 N2 P4 Ru -","- C912 H944 Cl48 N32 P64 Ru16 -","16","0.5","","Zhang, Hong; Feng, Li; Gong, Lei; Wu, Liqiong; He, Guomei; Wen, Tingbin; Yang, Fangzu; Xia, Haiping","Synthesis and Characterization of Stable Ruthenabenzenes Starting from HC⋮CCH(OH)C⋮CH","Organometallics","2007","26","10","2705","","10.1021/om070195k","","","0.71073","MoKα","","0.0925","0.075","","","0.1867","0.197","","","","","","1.103","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4074006","14.9422","0.0015","26.233","0.0016","40.473","0.003","90","","90","","90","","15865","2","173","2","173","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C22 H24 O3 Si -","- C22 H24 O3 Si -","- C704 H768 O96 Si32 -","32","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0464","0.0375","","","0.1023","0.1074","","","","","","1.031","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074810","22.6682","0.0013","24.2123","0.0008","24.2123","0.0008","90","","90","","90","","13288.9","1","173","2","173","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C36 H56 Hf2 N2 -","- C36 H56 Hf2 N2 -","- C576 H896 Hf32 N32 -","16","0.5","","Bernskoetter, Wesley H.; Olmos, Andrea V.; Lobkovsky, Emil; Chirik, Paul J.","N2Hydrogenation Promoted by a Side-On Bound Hafnocene Dinitrogen Complex","Organometallics","2006","25","4","1021","","10.1021/om0509037","","","0.71073","MoKα","","0.0459","0.0249","","","0.0525","0.057","","","","","","1.015","","","","has coordinates","178637","2020-10-21","18:00:00",""
"4075305","17.4931","0.0008","34.2786","0.0014","46.1932","0.0018","90","","90","","90","","27699","2","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C42 H74 B20 Cl Na O5 Y2 -","- C41 H50 B20 Cl Na O5 Y2 -","- C656 H800 B320 Cl16 Na16 O80 Y32 -","16","0.5","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis and Structural Characterization of New Carboranyl-Indenyl Ligands and Their Lanthanide Complexes","Organometallics","2006","25","10","2617","","10.1021/om0601955","","","0.71073","MoKα","","0.1454","0.0874","","","0.2747","0.2999","","","","","","0.946","","","","has coordinates","178642","2020-10-21","18:00:00",""
"4075306","17.5472","0.0008","34.6509","0.0015","46.269","0.002","90","","90","","90","","28133","2","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C42 H74 B20 Cl Er2 Na O5 -","- C41 H66 B20 Cl Er2 Na O5 -","- C656 H1056 B320 Cl16 Er32 Na16 O80 -","16","0.5","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis and Structural Characterization of New Carboranyl-Indenyl Ligands and Their Lanthanide Complexes","Organometallics","2006","25","10","2617","","10.1021/om0601955","","","0.71073","MoKα","","0.1448","0.0716","","","0.2324","0.2754","","","","","","0.978","","","","has coordinates","178642","2020-10-21","18:00:00",""
"4075459","20.681","0.003","22.191","0.003","25.607","0.003","90","","90","","90","","11752","3","143.2","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C26 H49 Fe2 N Si2 -","- C26 H49 Fe2 N Si2 -","- C416 H784 Fe32 N16 Si32 -","16","0.5","","Ohki, Yasuhiro; Takikawa, Yuko; Hatanaka, Tsubasa; Tatsumi, Kazuyuki","Reductive N−N Bond Cleavage of Diphenylhydrazine and Azobenzene Induced by Coordinatively Unsaturated Cp*Fe{N(SiMe3)2}","Organometallics","2006","25","13","3111","","10.1021/om0602963","","","0.7107","MoKα","","","0.0327","","","","0.0466","","","","","","0.897","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078838","11.046","0.0006","18.097","0.0011","29.2476","0.0017","90","","90","","90","","5846.6","0.6","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C26 H36 Au F6 N4 P -","- C26 H36 Au F6 N4 P -","- C208 H288 Au8 F48 N32 P8 -","8","0.25","","Sivaram, Haresh; Tan, Jackie; Huynh, Han Vinh","Syntheses, Characterizations, and a Preliminary Comparative Cytotoxicity Study of Gold(I) and Gold(III) Complexes Bearing Benzimidazole- and Pyrazole-Derived N-Heterocyclic Carbenes","Organometallics","2012","31","16","5875","","10.1021/om300444c","","","0.71073","MoKα","","0.0288","0.026","","","0.0736","0.0749","","","","","","1.139","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078841","12.8544","0.0006","18.6376","0.0008","24.9384","0.0011","90","","90","","90","","5974.6","0.5","100","2","100","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C26 H36 Au Cl2 F6 N4 P -","- C26 H36 Au Cl2 F6 N4 P -","- C208 H288 Au8 Cl16 F48 N32 P8 -","8","0.25","","Sivaram, Haresh; Tan, Jackie; Huynh, Han Vinh","Syntheses, Characterizations, and a Preliminary Comparative Cytotoxicity Study of Gold(I) and Gold(III) Complexes Bearing Benzimidazole- and Pyrazole-Derived N-Heterocyclic Carbenes","Organometallics","2012","31","16","5875","","10.1021/om300444c","","","0.71073","MoKα","","0.0179","0.0162","","","0.0397","0.0407","","","","","","1.075","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4079250","8.2063","0.0007","35.516","0.003","37.039","0.003","90","","90","","90","","10795.2","1.6","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","Complex_9","","","- C18 H24 Br2 N8 Pd S2 -","- C18 H24 Br2 N8 Pd S2 -","- C288 H384 Br32 N128 Pd16 S32 -","16","0.5","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0795","0.0602","","","0.1141","0.1192","","","","","","1.136","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079261","24.371","0.004","25.234","0.004","31.185","0.005","90","","90","","90","","19178","5","93","2","93","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C50 H66 B Cu F4 N4 -","- C50 H66 B Cu F4 N4 -","- C800 H1056 B16 Cu16 F64 N64 -","16","0.5","","Lazreg, Faïma; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Heteroleptic Bis(N-heterocyclic carbene)Copper(I) Complexes: Highly Efficient Systems for the [3+2] Cycloaddition of Azides and Alkynes","Organometallics","2012","31","22","7969","","10.1021/om3006195","","","0.71073","MoKα","","0.1212","0.0813","","","0.2426","0.2803","","","","","","1.038","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079651","21.737","0.003","43.49","0.009","44.52","0.009","90","","90","","90","","42087","13","100","","100","","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","Compound 2A","","","- C43.25 H38.5 Ag2 Au2 Cl2.5 F23 N O2 -","- C44.15 H18 Ag2 Au2 Cl2.5 F23 N O2 -","- C1412.8 H576 Ag64 Au64 Cl80 F736 N32 O64 -","32","1","","Savjani, Nicky; Wilkinson, Luke A.; Hughes, David L.; Schormann, Mark; Bochmann, Manfred","Synthesis, Structure, and Luminescent Behavior of Anionic Oligomeric and Polymeric Ag2Au2Clusters","Organometallics","2012","31","21","7600","","10.1021/om300911h","","","0.71075","MoKα","","0.0811","0.0789","","","0.1508","0.1518","","","","","","1.332","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4084294","18.726","0.0003","21.582","0.0003","49.735","0.0008","90","","90","","90","","20100.1","0.5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C65 H55 N2 Ni P2 -","- C65 H55 N2 Ni P2 -","- C1040 H880 N32 Ni16 P32 -","16","0.5","","Chen, Ming-Tsz; Lee, Wei-Ying; Tsai, Tzung-Ling; Liang, Lan-Chang","Nickel(II) Complexes Containing Bidentate Diarylamido Phosphine Chelates: Kumada Couplings Kinetically Preferred to β-Hydrogen Elimination","Organometallics","2014","33","20","5852","","10.1021/om5006353","","","0.71073","MoKα","","0.0702","0.0528","","","0.1431","0.1645","","","","","","1.136","","","","has coordinates","178731","2020-10-21","18:00:00",""
"4088825","11.364","0.006","24.534","0.013","24.644","0.013","90","","90","","90","","6871","6","100","1","100","1","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C40 H48 Fe N4 -","- C40 H48 Fe N4 -","- C320 H384 Fe8 N32 -","8","0.25","","Lee, Heejun; Campbell, Michael G.; Hernández Sánchez, Raúl; Börgel, Jonas; Raynaud, Jean; Parker, Sarah E.; Ritter, Tobias","Mechanistic Insight Into High-Spin Iron(I)-Catalyzed Butadiene Dimerization","Organometallics","2016","35","17","2923","","10.1021/acs.organomet.6b00474","","","0.71073","MoKα","","0.0506","0.0411","","","0.0967","0.1023","","","","","","1.051","","","","has coordinates","237847","2020-10-21","18:00:00",""
"4100865","26.8372","0.0018","27.313","0.003","38.801","0.003","90","","90","","90","","28441","4","100","2","100","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C96 H102 Cl4 F72 Ir4 O24 P12 -","- C96 H102 Cl4 F72 Ir4 O24 P12 -","- C768 H816 Cl32 F576 Ir32 O192 P96 -","8","0.25","","Arthur J. Esswein; Adam S. Veige; Daniel G.Nocera","","Journal of the American Chemical Society","2005","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","178754","2020-10-21","18:00:00",""
"4103187","21.7064","0.0007","29.0072","0.0011","43.7","0.003","90","","90","","90","","27515","2","150","2","150","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","UMCM-153","","","- C14 H7 Cu O5 -","- C14 H7 Cu O5 -","- C448 H224 Cu32 O160 -","32","1","","Jennifer K. Schnobrich; Olivier Lebel; Katie A. Cychosz; Anne Dailly; Antek G. Wong-Foy; Adam J. Matzger","Linker-Directed Vertex Desymmetrization for the Production of Coordination Polymers with High Porosity","Journal of the American Chemical Society","2010","132","","13941","13948","10.1021/ja107423k","","","1.54187","CuKα","","0.1064","0.0768","","","0.1949","0.2088","","","","","","0.988","","","","has coordinates","178777","2020-10-21","18:00:00",""
"4104301","19.6044","0.0013","22.9053","0.0015","32.804","0.002","90","","90","","90","","14730.5","1.6","273","2","273","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C72 H100 Ga6 N4 -","- C72 H100 Ga6 N4 -","- C576 H800 Ga48 N32 -","8","0.25","","Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Paul v. R. Schleyer; Gregory H. Robinson","A Neutral Ga6 Octahedron: Synthesis, Structure, and Aromaticity","Journal of the American Chemical Society","2009","131","","3168","3169","10.1021/ja809945v","","","0.71073","MoKα","","0.1176","0.057","","","0.1483","0.1814","","","","","","1.049","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4108225","12.933","0.0009","19.0074","0.0014","24.724","0.0018","90","","90","","90","","6077.7","0.8","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C32 H49 Ir O P2 -","- C32 H49 Ir O P2 -","- C256 H392 Ir8 O8 P16 -","8","0.25","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0312","0.0271","","","0.0612","0.0627","","","","","","1.075","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109877","28.594","0.004","31.866","0.004","38.241","0.005","90","","90","","90","","34844","8","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- Au H54 K15 O95 P2 W18 -","- Au K9 O91.5 P2 W18 -","- Au16 K144 O1464 P32 W288 -","16","0.5","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","","","0.71073","MoKα","","0.0628","0.054","","","0.2293","0.241","","","","","","1.048","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109880","28.605","0.005","31.857","0.005","38.273","0.006","90","","90","","90","","34877","10","96","2","96","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- Au H57 K9 O93.5 P2 W18 -","- Au K9 O93.5 P2 W18 -","- Au16 K144 O1496 P32 W288 -","16","0.5","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","","","0.71073","MoKα","","0.093","0.0552","","","0.1234","0.1309","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109881","28.721","0.018","31.61","0.04","39.159","0.014","90","","90","","90","","35551","5","30","","30","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- Au0.88 H20 K12.5 O80 P2 W18 -","- Au0.88 H20 K12.5 O80 P2 W18 -","- Au14.08 H320 K200 O1280 P32 W288 -","16","0.5","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","powder diffraction","neutron","","neutron,whitebeam","","0.193","0.186","","","","0.104","","","2.99","","","2.99","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4110532","46.374","0.002","51.581","0.002","53.407","0.002","90","","90","","90","","127750","9","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","COV-11CdS-FeBPy","","","- C258 H214 Cd32 Fe N6 S52 -","- C216 Cd32 Fe0.6295 S52 -","- C3456 Cd512 Fe10.072 S832 -","16","0.5","","Nanfeng Zheng; Haiwei Lu; Xianhui Bu; Pingyun Feng","Metal-Chelate Dye-Controlled Organization of Cd32S14(SPh)404- Nanoclusters into Three-Dimensional Molecular and Covalent Open Architecture","Journal of the American Chemical Society","2006","128","","4528","4529","10.1021/ja060006+","","","0.71073","MoKα","","0.142","0.0761","","","0.2607","0.3087","","","","","","1.152","","","","has coordinates","178876","2020-10-21","18:00:00",""
"4111132","24.601","0.005","16.546","0.004","65.775","0.014","90","","90","","90","","26774","10","150","2","150","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","MOF-Fe/AgOTf-3","","","- C54 H36 Ag Fe N9 -","- C54 H36 Ag Fe N9 -","- C864 H576 Ag16 Fe16 N144 -","16","0.5","","Sara R. Halper; Loi Do; Jay R. Stork; Seth M. Cohen","Topological Control in Heterometallic Metal-Organic Frameworks by Anion Templating and Metalloligand Design","Journal of the American Chemical Society","2006","128","","15255","15268","10.1021/ja0645483","","","0.71073","MoKα","","0.1132","0.0608","","","0.1638","0.1809","","","","","","0.756","","","","has coordinates,has disorder","178882","2020-10-21","18:00:00",""
"4112024","3.4099","0.0002","39.805","0.003","43.607","0.003","90","","90","","90","","5918.8","0.7","103","2","103","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C8 H25 Ag6 Cl N16 O7 -","- C8 H25 Ag6 Cl N16 O7 -","- C64 H200 Ag48 Cl8 N128 O56 -","8","0.25","","Jie-Peng Zhang; Yan-Yong Lin; Wei-Xiong Zhang; Xiao-Ming Chen","Temperature- or Guest-Induced Drastic Single-Crystal-to-Single-Crystal Transformations of a Nanoporous Coordination Polymer","Journal of the American Chemical Society","2005","127","","14162","14163","10.1021/ja054913a","","","0.71073","MoKα","","0.0725","0.0668","","","0.1637","0.1677","","","","","","1.034","","","","has coordinates","178891","2020-10-21","18:00:00",""
"4112121","20.066","0.004","40.221","0.007","67.924","0.013","90","","90","","90","","54820","18","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C144 H88 As2 B12 N12 O24.8 -","- C144 H88 As2 B12 N12 O24.8 -","- C2304 H1408 As32 B192 N192 O396.8 -","16","0.5","","Tiejun Li; Satish S. Jalisatgi; Michael J. Bayer; Andreas Maderna; Saeed I. Khan; M. Frederick Hawthorne","Organic Syntheses on an Icosahedral Borane Surface: Closomer Structures with Twelvefold Functionality","Journal of the American Chemical Society","2005","127","","17832","17841","10.1021/ja055226m","","","0.71073","MoKα","","0.2065","0.0615","","","0.1264","0.1926","","","","","","0.994","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4112836","11.2657","0.0018","20.517","0.004","34.413","0.007","90","","90","","90","","7954","3","193","2","193","1","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C30 H24 N10 Ni2 O12 -","- C30 H24 N10 Ni2 O12 -","- C240 H192 N80 Ni16 O96 -","8","0.25","","Ashleigh J. Fletcher; Edmund J. Cussen; Darren Bradshaw; Matthew J. Rosseinsky; K. Mark Thomas","Adsorption of Gases and Vapors on Nanoporous Ni2(4,4'-Bipyridine)3(NO3)4 Metal-Organic Framework Materials Templated with Methanol and Ethanol: Structural Effects in Adsorption Kinetics","Journal of the American Chemical Society","2004","126","","9750","9759","10.1021/ja0490267","","","0.71073","MoKα","","0.1359","0.0704","","","0.1972","0.2208","","","","","","0.9","","","","has coordinates,has disorder","178899","2020-10-21","18:00:00",""
"4114656","20.9026","0.0007","26.5756","0.0009","27.7713","0.001","90","","90","","90","","15426.9","0.9","193","2","193","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Calix[4]arene 1,3-alt tetramethylamide-HCl","","","- C40 H50 Cl N4 O11 -","- C40 H50 Cl N4 O11 -","- C640 H800 Cl16 N64 O176 -","16","0.5","","Vladimir Sidorov; Frank W. Kotch; Galya Abdrakhmanova; Robert Mizani; James C. Fettinger; Jeffery T. Davis","Ion Channel Formation from a Calix[4]arene Amide That Binds HCl","Journal of the American Chemical Society","2002","124","","2267","2278","10.1021/ja012338e","","","0.71073","MoKα","","0.0851","0.0617","","","0.1785","0.1958","","","","","","1.06","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4115011","8.66","0.006","38.787","0.026","56.28","0.037","90","","90","","90","","18904","2","129","2","129","2","","","","","","","synthetic","6","F d d d :2","-F 2uv 2vw","70","","","","- C48 H144 Cl9 N24 O24 Ru4 -","- C48 H96 Cl9.12 N24 O24.02 Ru4 -","- C384 H768 Cl72.96 N192 O192.16 Ru32 -","8","0.25","","Victor C. Lau; Louise A. Berben; Jeffrey R. Long","[(Cyclen)4Ru4(pz)4]9+: A Creutz-Taube Square","Journal of the American Chemical Society","2002","124","","9042","9043","10.1021/ja027114q","","","0.71073","MoKα","","0.1658","0.0794","","0.2486","0.1908","","","","1.019","1.186","1.186","","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115232","43.266","0.006","43.467","0.006","53.721","0.007","90","","90","","90","","101030","2","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","UCR-17","","","- C84.5 H182 Cu5 In30 N13 S54 -","- Cu4.74 In30.22 S54 -","- Cu75.84 In483.52 S864 -","16","0.5","","Xianhui Bu; Nanfeng Zheng; Yuqi Li; Pingyun Feng","Pushing Up the Size Limit of Chalcogenide Supertetrahedral Clusters: Two- and Three-Dimensional Photoluminescent Open Frameworks from (Cu5In30S54)13- Clusters","Journal of the American Chemical Society","2002","124","","12646","12647","10.1021/ja021009z","","","0.71073","MoKα","","0.1539","0.0735","","","0.2776","0.3123","","","","","","1.577","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115522","24.365","0.003","28.629","0.004","15.257","0.001","90","","90","","90","","10642","2","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C29 H24 N4 O9 -","- C29 H24 N4 O9 -","- C464 H384 N64 O144 -","16","0.5","","Ram Thaimattam; Feng Xue; Jagarlapudi A. R. P. Sarma; Thomas C. W. Mak; Gautam R. Desiraju","Inclusion Compounds of Tetrakis(4-nitrophenyl)methane: C-H...O Networks, Pseudopolymorphism, and Structural Transformations","Journal of the American Chemical Society","2001","123","","4432","4445","10.1021/ja0031826","","","0.71073","MoKα","","0.0881","0.0689","","","0.1821","0.1969","","","","","","1.163","","","","has coordinates","178926","2020-10-21","18:00:00",""
"4116116","17.904","0.0006","24.04","0.001","24.955","0.001","90","","90","","90","","10740.9","0.7","213","2","213","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C26 H22 Fe2 N4 O10 -","- C26 H22 Fe2 N4 O10 -","- C416 H352 Fe32 N64 O160 -","16","0.5","","Salma Kiani; Amy Tapper; Richard J. Staples; Pericles Stavropoulos","Functional Aspects of Gif-Type Oxidation of Hydrocarbons Mediated by Iron Picolinate H2O2-Dependent Systems: Evidence for the Generation of Carbon- and Oxygen-Centered Radicals","Journal of the American Chemical Society","2000","122","","7503","7517","10.1021/ja000063h","","","0.71073","MoKα","","0.0993","0.0352","","","0.0483","0.0522","","","","","","1.006","","","","has coordinates","178932","2020-10-21","18:00:00",""
"4116518","17.104","0.003","17.173","0.003","48.17","0.01","90","","90","","90","","14149","5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C32 H48 O4 Si2 Zr -","- C32 H48 O4 Si2 Zr -","- C512 H768 O64 Si32 Zr16 -","16","0.5","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.0458","0.0345","","0.0925","0.0886","","","","0.976","1.054","1.054","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116922","14.3337","0.0012","26.1271","0.0004","28.7758","0.0007","90","","90","","90","","10776.5","1","180.2","","180.2","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C60 H72 N8 Zn2 -","- C60 H72 N8 Zn -","- C480 H576 N64 Zn8 -","8","0.25","","Yongjun Zhang; Alison Thompson; Steven J. Rettig; David Dolphin","The Use of Dipyrromethene Ligands in Supramolecular Chemistry","Journal of the American Chemical Society","1998","120","","13537","13538","10.1021/ja9834982","","","0.7107","MoKα","","0.0684","0.039","","0.0712","","0.0712","","","1.582","","","1.58","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4117560","23.206","0.005","29.202","0.002","31.76","0.002","90","","90","","90","","21523","5","100","","100","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C114 H112 Cl6 Lu N16 S8 -","- C114 H112 Cl6 Lu N16 S8 -","- C912 H896 Cl48 Lu8 N128 S64 -","8","0.25","","Mehmet Menaf Ayhan; Anu Singh; Catherine Hirel; Ayşe Gül Gürek; Vefa Ahsen; Erwann Jeanneau; Isabelle Ledoux-Rak; Joseph Zyss; Chantal Andraud; Yann Bretonnière","ABAB Homoleptic Bis(phthalocyaninato)lutetium(III) Complex: Toward the Real Octupolar Cube and Giant Quadratic Hyperpolarizability","Journal of the American Chemical Society","2012","134","","3655","3658","10.1021/ja211064a","","","0.7107","MoKα","","0.0716","0.0591","","0.1704","0.1461","0.1704","","","","","","0.9565","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4119907","55.225","0.011","62.596","0.012","80.209","0.016","90","","90","","90","","277272","9","223","2","223","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C773 H1132 Cd48 N48 Nd16 O362 -","- C773 H1132 Cd48 N48 Nd16 O362 -","- C6184 H9056 Cd384 N384 Nd128 O2896 -","8","0.25","","Xiaoping Yang; Desmond Schipper; Richard A. Jones; Lauren A. Lytwak; Bradley J. Holliday; Shaoming Huang","Anion-Dependent Self-Assembly of Near-Infrared Luminescent 24- and 32-Metal Cd-Ln Complexes with Drum-like Architectures","Journal of the American Chemical Society","2013","135","","8468","8471","10.1021/ja4031243","","","0.710747","MoKα","","0.1622","0.0867","","","0.2167","0.2892","","","","","","1.081","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4119908","55.136","0.011","62.366","0.013","80.089","0.016","90","","90","","90","","275395","10","223","2","223","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C749 H1035 Cd48 Gd16 N48 O336 -","- C749 H1035 Cd48 Gd16 N48 O336 -","- C5992 H8280 Cd384 Gd128 N384 O2688 -","8","0.25","","Xiaoping Yang; Desmond Schipper; Richard A. Jones; Lauren A. Lytwak; Bradley J. Holliday; Shaoming Huang","Anion-Dependent Self-Assembly of Near-Infrared Luminescent 24- and 32-Metal Cd-Ln Complexes with Drum-like Architectures","Journal of the American Chemical Society","2013","135","","8468","8471","10.1021/ja4031243","","","0.710747","MoKα","","0.2186","0.0989","","","0.2384","0.2871","","","","","","1.08","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4119909","54.829","0.011","61.684","0.012","79.609","0.016","90","","90","","90","","269243","9","223","2","223","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C778 H1159 Cd48 Er16 N48 O382 -","- C778 H1159 Cd48 Er16 N48 O382 -","- C6224 H9272 Cd384 Er128 N384 O3056 -","8","0.25","","Xiaoping Yang; Desmond Schipper; Richard A. Jones; Lauren A. Lytwak; Bradley J. Holliday; Shaoming Huang","Anion-Dependent Self-Assembly of Near-Infrared Luminescent 24- and 32-Metal Cd-Ln Complexes with Drum-like Architectures","Journal of the American Chemical Society","2013","135","","8468","8471","10.1021/ja4031243","","","0.710747","MoKα","","0.2085","0.0952","","","0.2504","0.2972","","","","","","1.171","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4119910","54.549","0.011","61.511","0.012","79.622","0.016","90","","90","","90","","267161","9","223","2","223","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C770 H1144 Cd48 N48 O360 Yb16 -","- C770 H1144 Cd48 N48 O360 Yb16 -","- C6160 H9152 Cd384 N384 O2880 Yb128 -","8","0.25","","Xiaoping Yang; Desmond Schipper; Richard A. Jones; Lauren A. Lytwak; Bradley J. Holliday; Shaoming Huang","Anion-Dependent Self-Assembly of Near-Infrared Luminescent 24- and 32-Metal Cd-Ln Complexes with Drum-like Architectures","Journal of the American Chemical Society","2013","135","","8468","8471","10.1021/ja4031243","","","0.710747","MoKα","","0.1399","0.079","","","0.2089","0.2945","","","","","","1.177","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121944","8.744","0.003","20.762","0.006","34.408","0.011","90","","90","","90","","6247","3","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.057","0.0404","","0.1002","0.0941","0.1002","","","","","","0.9402","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121945","8.7977","0.0003","20.7323","0.001","34.3652","0.001","90","","90","","90","","6268.1","0.4","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C25.125 H16.5 O13.125 Sc2 -","- C26.056 H12 O14.056 Sc2 -","- C208.448 H96 O112.448 Sc16 -","8","0.25","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","1.54178","CuKα","","0.0823","0.0623","","0.17","0.1523","0.17","","","","","","0.9247","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121946","8.7682","0.0014","20.4694","0.0019","33.851","0.005","90","","90","","90","","6075.6","1.4","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C28.875 H31.5 O16.875 Sc2 -","- C28.84 H12 O16.84 Sc2 -","- C230.72 H96 O134.72 Sc16 -","8","0.25","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.1459","0.0988","","0.3014","0.2518","0.3014","","","","","","1.1704","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121948","8.8244","0.001","20.6223","0.0014","34.123","0.003","90","","90","","90","","6209.7","1","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C28.75 H31 O16.75 Sc2 -","- C29.16 H12 O17.16 Sc2 -","- C233.28 H96 O137.28 Sc16 -","8","0.25","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.1147","0.0794","","0.2502","0.2209","0.2502","","","","","","0.9897","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121950","8.7407","0.0004","20.7577","0.001","34.3372","0.0019","90","","90","","90","","6230","0.5","298","","298","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","1.54184","CuKα","","0.0459","0.04","","0.0862","0.0783","0.0862","","","","","","0.8154","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121951","8.8567","0.0016","20.693","0.002","34.249","0.006","90","","90","","90","","6276.9","1.7","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C28 H28 O16 Sc2 -","- C27.96 H12 O15.96 Sc2 -","- C223.68 H96 O127.68 Sc16 -","8","0.25","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.1362","0.0889","","0.2102","0.189","0.2102","","","","","","1.0483","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121952","8.7316","0.0005","20.7231","0.0007","34.3055","0.0014","90","","90","","90","","6207.4","0.5","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.0769","0.044","","0.127","0.1131","0.127","","","","","","0.8514","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121953","8.8641","0.0017","20.698","0.002","34.229","0.006","90","","90","","90","","6280","1.7","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C28.875 H31.5 O16.875 Sc2 -","- C28.76 H12 O16.76 Sc2 -","- C230.08 H96 O134.08 Sc16 -","8","0.25","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.1783","0.099","","0.2876","0.2417","0.2876","","","","","","0.9424","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121957","8.7467","0.0002","20.7505","0.0004","34.3708","0.0006","90","","90","","90","","6238.2","0.2","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 O12 Sc2 -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.0951","0.0537","","0.1001","0.0906","0.1001","","","","","","0.9236","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121958","8.8041","0.0015","20.625","0.002","34.062","0.005","90","","90","","90","","6185.1","1.5","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C29.25 H33 O17.25 Sc2 -","- C29.2 H12 O17.2 Sc2 -","- C233.6 H96 O137.6 Sc16 -","8","0.25","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.1444","0.0999","","0.3144","0.2676","0.3144","","","","","","0.9051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4121962","8.851","0.002","20.676","0.003","34.203","0.007","90","","90","","90","","6259","2","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C29.125 H32.5 O17.125 Sc2 -","- C29.24 H12 O17.24 Sc2 -","- C233.92 H96 O137.92 Sc16 -","8","0.25","","Graham, Alexander J.; Banu, Ana-Maria; Düren, Tina; Greenaway, Alex; McKellar, Scott C.; Mowat, John P. S.; Ward, Kenneth; Wright, Paul A.; Moggach, Stephen A.","Stabilization of Scandium Terephthalate MOFs against Reversible Amorphization and Structural Phase Transition by Guest Uptake at Extreme Pressure.","Journal of the American Chemical Society","2014","136","24","8606","8613","10.1021/ja411934f","","","0.71073","MoKα","","0.1803","0.0919","","0.2526","0.2118","0.2526","","","","","","0.9746","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4124469","23.072","","11.557","","5.543","","90","","90","","90","","1478","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K2 Fe (C O)4","","- C4 Fe K2 O4 -","- C4 Fe K2 O4 -","- C32 Fe8 K16 O32 -","8","0.25","","Teller, R.G.; Finke, R.G.; Bau, R.; Collman, J.P.; Chin, H.B.","Dependence of the (Fe (C O)4)(2-) geometry on counterion: crystal structures of K2 Fe (C O)4 and (Na(Crypt))2(Fe (C O)4) (Crypt=N(CH2CH2OCH2CH2OCH2CH2)3N)","Journal of the American Chemical Society","1977","99","","1104","1111","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4126701","38.4922","0.0007","41.1905","0.0006","50.5849","0.0007","90","","90","","90","","80203","2","273","2","273","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C148 H98 N4 O38 Ti4 -","- C148 H98 N4 O38 Ti4 -","- C2368 H1568 N64 O608 Ti64 -","16","0.5","","He, Yan-Ping; Yuan, Lv-Bing; Chen, Guang-Hui; Lin, Qi-Pu; Wang, Fei; Zhang, Lei; Zhang, Jian","Water Soluble and Ultra-Stable Ti4L6 Tetrahedron with Coordination Assembly Function.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b09463","","","1.54178","CuKα","","0.0906","0.067","","","0.1819","0.1992","","","","","","0.922","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4130841","21.5579","0.0005","21.7446","0.0007","46.7236","0.0015","90","","90","","90","","21902.5","1.1","123","2","123","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C48.5 H73 As3 N6 Si3 -","- C48 H72.75 As3 N6 Si3 -","- C768 H1164 As48 N96 Si48 -","16","0.5","","Seitz, Andreas E.; Eckhardt, Maria; Erlebach, Andreas; Peresypkina, Eugenia V.; Sierka, Marek; Scheer, Manfred","Pnictogen-Silicon Analogues of Benzene.","Journal of the American Chemical Society","2016","138","33","10433","10436","10.1021/jacs.6b07389","","","1.54178","CuKα","","0.0583","0.0402","","","0.0977","0.1023","","","","","","1.002","","","","has coordinates,has disorder","241200","2020-10-21","18:00:00",""
"4131598","21.096","0.006","36.965","0.01","44.576","0.013","90","","90","","90","","34761","17","93","2","93","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C44 H35 N1.5 -","- C44 H35 N1.5 -","- C1408 H1120 N48 -","32","1","","Lu, Xuefeng; Lee, Sangsu; Hong, Yongseok; Phan, Hoa; Gopalakrishna, Tullimilli Y.; Herng, Tun Seng; Tanaka, Takayuki; Sandoval-Salinas, María Eugenia; Zeng, Wangdong; Ding, Jun; Casanova, David; Osuka, Atsuhiro; Kim, Dongho; Wu, Jishan","Fluorenyl Based Macrocyclic Polyradicaloids.","Journal of the American Chemical Society","2017","139","37","13173","13183","10.1021/jacs.7b07335","","","1.54187","CuKα","","0.1201","0.092","","","0.243","0.276","","","","","","1.052","","","","has coordinates,has disorder","241775","2020-10-21","18:00:00",""
"4131678","11.4339","0.0003","40.051","0.0011","54.661","0.002","90","","90","","90","","25031.4","1.3","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C73 H81 Cl2 N4 Ru2 -","- C64 H72 Cl2 N4 Ru2 -","- C1024 H1152 Cl32 N64 Ru32 -","16","0.5","","Bailey, Gwendolyn A.; Lummiss, Justin A. M.; Foscato, Marco; Occhipinti, Giovanni; McDonald, Robert; Jensen, Vidar R.; Fogg, Deryn E.","Decomposition of Olefin Metathesis Catalysts by Brønsted Base: Metallacyclobutane Deprotonation as a Primary Deactivating Event.","Journal of the American Chemical Society","2017","139","46","16446","16449","10.1021/jacs.7b08578","","","1.54178","CuKα","","0.0825","0.0658","","","0.1688","0.1877","","","","","","1.191","","","","has coordinates,has disorder","241851","2020-10-21","18:00:00",""
"4132090","24.088","0.0006","60.3283","0.0014","67.581","0.003","90","","90","","90","","98208","5","100","2","100.15","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C177.96 H221.9 N43.99 O40 P2 -","- C173.952 H191.88 N43.494 O40 P2 -","- C2783.23 H3070.08 N695.904 O640 P32 -","16","0.5","","Zhang, Wenyao; Yang, Dong; Zhao, Jie; Hou, Lekai; Sessler, Jonathan L.; Yang, Xiao-Juan; Wu, Biao","Controlling the Recognition and Reactivity of Alkyl Ammonium Guests Using an Anion Coordination-Based Tetrahedral Cage.","Journal of the American Chemical Society","2018","140","15","5248","5256","10.1021/jacs.8b01488","","","1.54178","CuKα","","0.1212","0.1017","","","0.2761","0.2891","","","","","","1.132","","","","has coordinates","242128","2020-10-21","18:00:00",""
"4133182","15.0781","0.0006","19.0103","0.0007","29.5991","0.0016","90","","90","","90","","8484.3","0.6","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C46 H56 Br N4 Ni -","- C46 H56 Br N4 Ni -","- C368 H448 Br8 N32 Ni8 -","8","0.25","","Cao, Zhi-Chao; Xie, Si-Jun; Fang, Huayi; Shi, Zhang-Jie","Ni-Catalyzed Cross-Coupling of Dimethyl Aryl Amines with Arylboronic Esters under Reductive Conditions.","Journal of the American Chemical Society","2018","140","42","13575","13579","10.1021/jacs.8b08779","","","1.34138","GaKα","","0.0928","0.0866","","","0.2476","0.2514","","","","","","1.136","","","","has coordinates","243018","2020-10-21","18:00:00",""
"4133667","11.987","0.003","39.23","0.008","47.618","0.011","90","","90","","90","","22392","9","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C14 H8 N0 O8 Zn2 -","- C14 H8 O8 Zn2 -","- C448 H256 O256 Zn64 -","32","1","","Yang, Huajun; Peng, Fang; Dang, Candy; Wang, Yong; Hu, Dandan; Zhao, Xiang; Feng, Pingyun; Bu, Xianhui","Ligand Charge Separation To Build Highly Stable Quasi-Isomer of MOF-74-Zn.","Journal of the American Chemical Society","2019","141","25","9808","9812","10.1021/jacs.9b04432","","","0.71073","MoKα","","0.1059","0.0695","","","0.2016","0.2291","","","","","","1.115","","","","has coordinates","243404","2020-10-21","18:00:00",""
"4133673","20.2514","0.0002","35.0504","0.0002","42.5407","0.0002","90","","90","","90","","30196.2","0.4","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","HCOF-3","","","- C34 H25 N12 S2 -","- C34 H25 N12 S2 -","- C1088 H800 N384 S64 -","32","1","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","x-ray","0.61992","synchrotron","","0.1723","0.1676","","","0.4469","0.4597","","","","","","2.248","","","","has coordinates,has disorder","243410","2020-10-21","18:00:00",""
"4133674","20.144","0.0003","34.7052","0.0004","42.3035","0.0003","90","","90","","90","","29574.4","0.6","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","P7","","","- C29 H27 N12 S -","- C29 H27 N12 S0.995 -","- C928 H864 N384 S31.84 -","32","1","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","x-ray","0.61992","synchrotron","","0.1489","0.1365","","","0.4046","0.4231","","","","","","1.733","","","","has coordinates,has disorder","243411","2020-10-21","18:00:00",""
"4133675","19.9929","0.0001","34.6322","0.0002","42.3319","0.0002","90","","90","","90","","29310.5","0.3","100","","100","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","P6","","","- C61 H58 N24 S2 -","- C61 H58 N24 S2 -","- C976 H928 N384 S32 -","16","0.5","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","","0.61992","synchrotron","","0.176","0.1708","","","0.482","0.4966","","","","","","2.476","","","","has coordinates,has disorder","243412","2020-10-21","18:00:00",""
"4133676","21.0124","0.0004","35.3974","0.0003","42.5092","0.0002","90","","90","","90","","31617.7","0.7","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","HCOF-2","","","- C33 H26 N12 S2 -","- C33 H26 N12 S2 -","- C1056 H832 N384 S64 -","32","1","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","x-ray","0.61992","synchrotron","","0.1901","0.183","","","0.4531","0.4665","","","","","","2.152","","","","has coordinates,has disorder","243413","2020-10-21","18:00:00",""
"4133677","20.8296","0.0002","35.3105","0.0003","42.4936","0.0002","90","","90","","90","","31254.2","0.4","100","2","100","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","HCOF-4","","","- C30 H25 N12 -","- C29.99 H24.98 N12 -","- C959.68 H799.36 N384 -","32","1","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","x-ray","0.61992","synchrotron","","0.1798","0.1761","","","0.4285","0.4405","","","","","","2.043","","","","has coordinates,has disorder","243414","2020-10-21","18:00:00",""
"4133678","20.5062","0.0013","35.21","0.002","42.652","0.004","90","","90","","90","","30796","4","150","2","150","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","monomer 1","","","- C62 H68 N24 -","- C62 H68 N24 -","- C992 H1088 N384 -","16","0.5","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","","0.71073","MoKα","","0.1047","0.0913","","","0.2578","0.2713","","","","","","1.055","","","","has coordinates,has disorder","243415","2020-10-21","18:00:00",""
"4133679","20.6068","0.0005","35.009","0.001","42.3618","0.001","90","","90","","90","","30560.8","1.4","150","2","150","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C58 H68 N24 -","- C58 H68 N24 -","- C928 H1088 N384 -","16","0.5","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","","1.54178","CuKα","","0.1287","0.0986","","","0.3052","0.3365","","","","","","1.29","","","","has coordinates,has disorder","243416","2020-10-21","18:00:00",""
"4133680","19.6681","0.0012","34.306","0.002","42.246","0.002","90","","90","","90","","28505","3","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","P5","","","- C30 H34 N12 S -","- C30 H34 N12 S -","- C960 H1088 N384 S32 -","32","1","","Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng","Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.","Journal of the American Chemical Society","2019","141","27","10915","10923","10.1021/jacs.9b05232","","","0.71073","MoKα","","0.1482","0.1386","","","0.4079","0.4218","","","","","","1.999","","","","has coordinates","243417","2020-10-21","18:00:00",""
"4300086","11.09","0.002","23.206","0.005","23.91","0.005","90","","90","","90","","6153","2","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C20 H40 Cu4 N6 Se4 W -","- C20 Cu4 N6 Se4 W -","- C160 Cu32 N48 Se32 W8 -","8","0.25","","Qian-Feng Zhang; Wa-Hung Leung; Xin; Hoong-Kun Fun","Heterometallic Polymeric Clusters Containing Tetraselenotungstate Anion: One-Dimensional Helical Chain {[La(Me2SO)8][(μ-WSe4)3Ag3]}n and Cyanide-Bridged Three-Dimensional Cross-Framework {[Et4N]2[(μ4-WSe4)Cu4(CN)4]}n","Inorganic Chemistry","2000","39","","417","426","10.1021/ic990780g","","","0.71073","MoKα","","0.0799","0.0428","","0.0983","0.0887","","","","0.959","1.062","1.062","","","","","has coordinates","179038","2020-10-21","18:00:00",""
"4301444","20.84","0.002","25.57","0.002","28.74","0.003","90","","90","","90","","15315","2","298","2","298","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H16 Cl2 Cu2 N6 -","- C16 H16 Cl2 Cu2 N6 -","- C512 H512 Cl64 Cu64 N192 -","32","1","","Man-Cheng Hu; Yan Wang; Quan-Guo Zhai; Shu-Ni Li; Yu-Cheng Jiang; Yong Zhang","Synthesis, Crystal Structures, and Photoluminescent Properties of the Cu(I)/X/α,ω-Bis(benzotriazole)alkane Hybrid Family (X = Cl, Br, I, and CN)","Inorganic Chemistry","2009","48","","1449","1468","10.1021/ic801574k","","","0.71073","MoKα","","0.1351","0.076","","","0.1933","0.2563","","","","","","1.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4301903","39.369","0.003","39.416","0.003","39.411","0.003","90","","90","","90","","61157","8","153","2","153","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C106 H106 Co9 N74 O41 -","- C106 H84 Co9 N74 O41 -","- C1696 H1344 Co144 N1184 O656 -","16","0.5","","Louise N. Dawe; Konstantin V. Shuvaev; Laurence K. Thompson","Magnetic [nxn] (n= 2-5) Grids by Directed Self-Assembly","Inorganic Chemistry","2009","48","","3323","3341","10.1021/ic801078h","","","0.7107","MoKα","","0.1065","0.0988","","","0.2797","0.2877","","","","","","1.185","","","","has coordinates","179057","2020-10-21","18:00:00",""
"4303239","31.8557","0.0019","34.817","0.002","52.617","0.003","90","","90","","90","","58359","6","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C112 H68 N12 O8 Zn4 -","- C112 H68 N12 O8 Zn4 -","- C896 H544 N96 O64 Zn32 -","8","0.25","","Jennifer M. Verduzco; Haemi Chung; Chunhua Hu; Wonyoung Choe","Metal-Organic Framework Assembled from T-Shaped and Octahedral Nodes: A Mixed-Linker Strategy To Create a Rare Anatase TiO2 Topology","Inorganic Chemistry","2009","48","","9060","9062","10.1021/ic9009916","","","0.71073","MoKα","","0.0986","0.0408","","","0.0831","0.0901","","","","","","1.077","","","","has coordinates,has disorder","179070","2020-10-21","18:00:00",""
"4303340","21.4951","0.0014","25.6925","0.0014","37.072","0.003","90","","90","","90","","20473","2","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C54 H72 Ag F6 N4 Sb -","- C54 H72 Ag F6 N4 Sb -","- C864 H1152 Ag16 F96 N64 Sb16 -","16","0.5","","David V. Partyka; Nihal Deligonul","Phosphine- and Carbene-Ligated Silver Acetate: Easily-Accessed Synthons for Reactions with Silylated Nucleophiles","Inorganic Chemistry","2009","48","","9463","9475","10.1021/ic901371g","","","0.71073","MoKα","","0.0207","0.0182","","","0.0467","0.0491","","","","","","1.043","","","","has coordinates","179071","2020-10-21","18:00:00",""
"4304490","21.1979","0.0004","21.1625","0.0007","12.7216","0.0007","90","","90","","90","","5706.9","0.4","296","2","296","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Ga4 La Na Se8 -","- Ga4 La Na Se8 -","- Ga64 La16 Na16 Se128 -","16","0.5","","Amitava Choudhury; Peter K. Dorhout","Synthesis, Structure, and Optical Properties of the Quaternary Seleno-gallates NaLnGa4Se8 (Ln= La, Ce, Nd) and Their Comparison with the Isostructural Thio-gallates","Inorganic Chemistry","2008","47","","3603","3609","10.1021/ic701986j","","","0.71073","MoKα","","0.0647","0.045","","","0.1132","0.122","","","","","","1.084","","","","has coordinates","179082","2020-10-21","18:00:00",""
"4304491","21.1416","0.0018","21.138","0.0018","12.7125","0.0011","90","","90","","90","","5681.1","0.8","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Ce Ga4 Na Se8 -","- Ce Ga4 Na Se8 -","- Ce16 Ga64 Na16 Se128 -","16","0.5","","Amitava Choudhury; Peter K. Dorhout","Synthesis, Structure, and Optical Properties of the Quaternary Seleno-gallates NaLnGa4Se8 (Ln= La, Ce, Nd) and Their Comparison with the Isostructural Thio-gallates","Inorganic Chemistry","2008","47","","3603","3609","10.1021/ic701986j","","","0.71073","MoKα","","0.0383","0.0281","","","0.0556","0.0596","","","","","","1.035","","","","has coordinates","179082","2020-10-21","18:00:00",""
"4304492","21.015","0.002","21.045","0.0019","12.7093","0.0012","90","","90","","90","","5620.8","0.9","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Ga4 Na Nd Se8 -","- Ga4 Na Nd Se8 -","- Ga64 Na16 Nd16 Se128 -","16","0.5","","Amitava Choudhury; Peter K. Dorhout","Synthesis, Structure, and Optical Properties of the Quaternary Seleno-gallates NaLnGa4Se8 (Ln= La, Ce, Nd) and Their Comparison with the Isostructural Thio-gallates","Inorganic Chemistry","2008","47","","3603","3609","10.1021/ic701986j","","","0.71073","MoKα","","0.053","0.0369","","","0.0683","0.0745","","","","","","1.092","","","","has coordinates","179082","2020-10-21","18:00:00",""
"4304501","8.7094","0.0017","10.028","0.002","24.157","0.005","90","","90","","90","","2109.8","0.7","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Au4 K Sn6 -","- Au4 K Sn6 -","- Au32 K8 Sn48 -","8","0.25","","Bin Li; John D. Corbett","Similar K@Au10Sn10 Polyhedra in the Markedly Different Structures of KAu4Sn6 and KAu3Sn3. Syntheses and Characterization","Inorganic Chemistry","2008","47","","3610","3616","10.1021/ic701997x","","","0.71073","MoKα","","0.0465","0.0408","","","0.1011","0.104","","","","","","1.105","","","","has coordinates","179083","2020-10-21","18:00:00",""
"4305443","6.9317","0.0013","20.885","0.005","36.459","0.005","90","","90","","90","","5278.1","1.8","293","","293","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C28 H16 Au2 N8 Pb -","- C28 H16 Au2 N8 Pb -","- C224 H128 Au16 N64 Pb8 -","8","0.25","","Michael J. Katz; Vladimir K. Michaelis; Pedro M. Aguilar; Renante Yson; Haiyan Lu; Harini Kaluarachchi; Raymond J. Batchelor; Georg Schreckenbach; Scott Kroeker; Howard H. Patterson; Daniel B. Leznoff","Structural and Spectroscopic Impact of Tuning the Stereochemical Activity of the Lone Pair in Lead(II) Cyanoaurate Coordination Polymers via Ancillary Ligands","Inorganic Chemistry","2008","47","","6353","6363","10.1021/ic800425f","","","0.71073","MoKα","","0.1012","0.0381","","0.0746","0.0554","0.0554","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4305447","13.7123","0.0004","26.3955","0.0008","26.7143","0.0008","90","","90","","90","","9669.1","0.5","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C32 H76 Cl4 Li4 O4 P4 -","- C32 H76 Cl4 Li4 O4 P4 -","- C256 H608 Cl32 Li32 O32 P32 -","8","0.25","","Bhaskar Reddy Aluri; Markus K. Kindermann; Peter G. Jones; Ina Dix; Joachim Heinicke","Bulky N-Substituted 1,3-Benzazaphospholes: Access via Pd-Catalyzed C-N and C-P Cross Coupling, Lithiation, and Conversion to Novel P=C-PtBu2 Hybrid Ligands","Inorganic Chemistry","2008","47","","6900","6912","10.1021/ic800430f","","","1.54178","CuKα","","0.0253","0.0244","","","0.0666","0.0675","","","","","","1.079","","","","has coordinates","179092","2020-10-21","18:00:00",""
"4306507","16.181","0.003","17.327","0.003","27.663","0.006","90","","90","","90","","7756","3","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C16 H26 Cl2 N2 O2 Zn -","- C16 H26 Cl2 N2 O2 Zn -","- C256 H416 Cl32 N32 O32 Zn16 -","16","0.5","","Bi-Xue Zhu; Qi-Long Zhang; Yun-Qian Zhang; Tao Zhu; Jack K. Clegg; Leonard F. Lindoy; Gang Wei","Four Zinc(II) Helical Coordination Polymers and 78-Membered Six-Node Zinc Metallacycle Assembled from Diastereopure N,N'-Bis(acetylacetone)cyclohexanediimine","Inorganic Chemistry","2008","47","","10053","10061","10.1021/ic801329g","","","0.71073","MoKα","","0.0308","0.0243","","","0.0672","0.0698","","","","","","1.063","","","","has coordinates","179103","2020-10-21","18:00:00",""
"4306734","14.9431","0.0003","27.2374","0.0006","34.754","0.0008","90","","90","","90","","14145.3","0.5","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C84 H68 Mn N2 P4 S4 -","- C84 H68 Mn N2 P4 S4 -","- C672 H544 Mn8 N16 P32 S32 -","8","0.25","","Chia-Huei Lin; Chien-Ge Chen; Ming-Li Tsai; Gene-Hsiang Lee; Wen-Feng Liaw","Monoanionic {Mn(NO)}5 and Dianionic {Mn(NO)}6 Thiolatonitrosylmanganese Complexes: [(NO)Mn(L)2]- and [(NO)Mn(L)2]2- (LH2= 1,2-Benzenedithiol and Toluene-3,4-dithiol)","Inorganic Chemistry","2008","47","","11435","11443","10.1021/ic801553s","","","0.71073","MoKα","","0.0548","0.0437","","","0.1035","0.1095","","","","","","1.034","","","","has coordinates","179105","2020-10-21","18:00:00",""
"4307216","9.1928","0.0002","14.209","0.0001","32.2971","0.0006","90","","90","","90","","4218.66","0.12","293","2","293","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C4 H20 F N4 Nb O17 P4 Zn3 -","- C4 H6 F2 N4 Nb O16 P4 Zn3 -","- C32 H48 F16 N32 Nb8 O128 P32 Zn24 -","8","0.25","","Guang-Zhen Liu; Shou-Tian Zheng; Guo-Yu Yang","Two Organically Templated Niobium and Zinconiobium Fluorophosphates: Low Temperature Hydrothermal Syntheses of NbOF(PO4)2(C2H10N2)2 and Zn3(NbOF)(PO4)4(C2H10N2)2","Inorganic Chemistry","2007","46","","231","237","10.1021/ic061752i","","","0.71073","MoKα","","0.0796","0.0793","","","0.17","0.1701","","","","","","1.291","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307298","9.6976","0.0002","15.4428","0.0004","27.4205","0.0006","90","","90","","90","","4106.44","0.16","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C10 H20 Eu2 O20 -","- C10 H12 Eu2 O20 -","- C80 H96 Eu16 O160 -","8","0.25","","Wen-Hua Zhu; Zhe-Ming Wang; Song Gao","Two 3D Porous Lanthanide-Fumarate-Oxalate Frameworks Exhibiting Framework Dynamics and Luminescent Change upon Reversible De- and Rehydration","Inorganic Chemistry","2007","46","","1337","1342","10.1021/ic061833e","","","0.71073","MoKα","","0.0455","0.0275","","","0.0607","0.0641","","","","","","0.974","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307299","9.6648","0.0002","15.4844","0.0003","27.1305","0.0006","90","","90","","90","","4060.18","0.15","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C10 H20 O20 Tb2 -","- C10 H12 O20 Tb2 -","- C80 H96 O160 Tb16 -","8","0.25","","Wen-Hua Zhu; Zhe-Ming Wang; Song Gao","Two 3D Porous Lanthanide-Fumarate-Oxalate Frameworks Exhibiting Framework Dynamics and Luminescent Change upon Reversible De- and Rehydration","Inorganic Chemistry","2007","46","","1337","1342","10.1021/ic061833e","","","0.71073","MoKα","","0.0294","0.0212","","","0.0542","0.0563","","","","","","1.034","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307740","10.642","0.003","16.477","0.005","29.817","0.008","90","","90","","90","","5228","3","99","2","99","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","[Co(C5H5N)2(N3)2(H2O)]n","","","- C10 H12 Co N8 O -","- C10 H12 Co N8 O -","- C160 H192 Co16 N128 O16 -","16","0.5","","Morsy A. M. Abu-Youssef; Franz A. Mautner; Ramon Vicente","1D and 2D End-to-End Azide-Bridged Cobalt(II) Complexes: Syntheses, Crystal Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","4654","4659","10.1021/ic0622297","","","0.71069","MoKα","","0.0525","0.0376","","0.105","","0.091","","","1.056","","","1.042","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307768","18.6771","0.0016","30.5524","0.0016","52.567","0.003","90","","90","","90","","29996","3","293","2","293","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C112 H108 B4 Cl4 Fe4 N52 Ni4 O28 -","- C112 H108 B4 Cl4 Fe4 N52 Ni4 O28 -","- C896 H864 B32 Cl32 Fe32 N416 Ni32 O224 -","8","0.25","","Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You","Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","3236","3244","10.1021/ic062267q","","","0.71073","MoKα","","0.1136","0.0667","","","0.1366","0.1459","","","","","","1.014","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4308017","8.763","0.005","25.607","0.005","31.505","0.005","90","0.005","90","0.005","90","0.005","7070","4","173","","173","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H42 Cl10 O4 Te2 -","- C8 H21 Cl5 O2 Te -","- C128 H336 Cl80 O32 Te16 -","16","0.5","","Jens Beckmann; Stephan Heitz; Malte Hesse","Four Distinctively Different Decomposition Pathways of Metastable Supermesityltellurium(IV) Trichloride","Inorganic Chemistry","2007","46","","3275","3282","10.1021/ic062469m","","","0.71069","MoKα","","0.0629","0.0542","","","0.0965","0.0993","","","","","","1.393","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4310605","21.947","0.001","28.636","0.001","56.476","0.002","90","","90","","90","","35494","2","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C96 H144 Cl8 N32 O36 Zr6 -","- C96 H144 Cl8 N32 O36 Zr6 -","- C768 H1152 Cl64 N256 O288 Zr48 -","8","0.25","","A. Otero; J. Fernández-Baeza; A. Antiñolo; J. Tejeda; A. Lara-Sánchez; L. Sánchez-Barba; M. Fernández-López; I. López-Solera","New Complexes of Zirconium(IV) and Hafnium(IV) with Heteroscorpionate Ligands and the Hydrolysis of Such Complexes To Give a Zirconium Cluster#","Inorganic Chemistry","2004","43","","1350","1358","10.1021/ic035067c","","","0.71073","MoKα","","0.2109","0.1242","","","0.3693","0.412","","","","","","1.398","","","","has coordinates","179145","2020-10-21","18:00:00",""
"4310712","15.913","0.002","21.616","0.004","42.739","0.01","90","","90","","90","","14701","5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C64 H52 Cu5 N8 O18 -","- C64 H48 Cu5 N8 O18 -","- C512 H384 Cu40 N64 O144 -","8","0.25","","Hong Zhao; Zhi-Rong Qu; Qiong Ye; Xi-Sen Wang; Jing Zhang; Ren-Gen Xiong; Xiao-Zeng You","An Unusual Mixed-Valence Cu(I)-Cu(II) 3-D Framework","Inorganic Chemistry","2004","43","","1813","1815","10.1021/ic034943j","","","0.71073","MoKα","","0.2032","0.0892","","","0.2459","0.3197","","","","","","0.993","","","","has coordinates","179146","2020-10-21","18:00:00",""
"4312303","19.9779","0.0013","22.2432","0.0014","25.9316","0.0017","90","","90","","90","","11523.3","1.3","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C60 H44 Cu2 F12 N12 P2 -","- C60 H32 Cu2 F12 N12 P2 -","- C480 H256 Cu16 F96 N96 P16 -","8","0.25","","Elvira C. Riesgo; Yi-Zhen Hu; Randolph P. Thummel","Cu(I) Complexes of 3,3'-Polymethylene Bridged Derivatives of 2,2'-Bi-1,10-Phenanthroline","Inorganic Chemistry","2003","42","","6648","6654","10.1021/ic0300417","","","0.71073","MoKα","","0.0917","0.0667","","","0.1702","0.1966","","","","","","1.217","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4313096","12.2321","0.001","24.965","0.002","57.688","0.005","90","","90","","90","","17616","3","153","2","153","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C28 H57 Ag0.5 N8.5 O3 S7 W2 -","- C28 Ag0.5 N8.5 O3 S7 W2 -","- C448 Ag8 N136 O48 S112 W32 -","16","0.5","","Wenjian Zhang; Xintao Wu; Biao Wu; Shuyan Yu; Gabriella Santoni; Dieter Rehder","Double-Stranded W/Ag/S Chain Structure Generated from [syn-{WO(NCS)2}2(μ-S)2] Building Blocks","Inorganic Chemistry","2003","42","","1130","1134","10.1021/ic020510p","","","0.71073","MoKα","","0.078","0.0604","","","0.1584","0.1641","","","","","","1.096","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4314210","11.6282","0.0003","15.3443","0.0004","22.2933","0.0007","90","","90","","90","","3977.72","0.19","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C8 H28 Ca Cl2 O12 -","- C8 H28 Ca Cl2 O12 -","- C64 H224 Ca8 Cl16 O96 -","8","0.25","","Limin Yang; Yunlan Su; Yizhuang Xu; Zheming Wang; Zonghui Guo; Shifu Weng; Chunhua Yan; Shiwei Zhang; Jinguang Wu","Interactions between Metal Ions and Carbohydrates. Coordination Behavior of Neutral Erythritol to Ca(II) and Lanthanide Ions","Inorganic Chemistry","2003","42","","5844","5856","10.1021/ic0300464","","","0.71073","MoKα","","0.0711","0.0631","","","0.1919","0.199","","","","","","1.085","","","","has coordinates","179214","2020-10-21","18:00:00",""
"4314288","26.5959","0.0017","27.2378","0.0017","29.7981","0.0019","90","","90","","90","","21586","2","273","2","273","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","tetrakis(N,N'-di(p-chlorophenyl)formamidinate)divanadium(II,II)","","- C52 H36 Cl8 N8 V2 -","- C52 H36 Cl8 N8 V2 -","- C832 H576 Cl128 N128 V32 -","16","0.5","","F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo; Xiaoping Wang","New Chemistry of the Triply Bonded Divanadium (V24+) Unit and Reduction to an Unprecedented V23+ Core","Inorganic Chemistry","2003","42","","6063","6070","10.1021/ic034646e","","","0.71073","MoKα","","0.0603","0.0369","","","0.086","0.0997","","","","","","1.026","","","","has coordinates","179214","2020-10-21","18:00:00",""
"4314674","25.9858","0.0017","34.018","0.002","38.21","0.003","90","","90","","90","","33777","4","571","2","571","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","bis(bis((8-benzyloxyquinolin-2-yl)methylene)-rac-1,2-cyclohexanediamine) -di-copper(II) tetratriflate","","","- C84 H72 Cu2 F12 N8 O16 S4 -","- C84 H72 Cu2 F12 N8 O16 S4 -","- C1344 H1152 Cu32 F192 N128 O256 S64 -","16","0.5","","Valeria Amendola; Massimo Boiocchi; Valentina Brega; Luigi Fabbrizzi; Lorenzo Mosca","Octahedral Copper(II) and Tetrahedral Copper(I) Double-Strand Helicates: Chiral Self-Recognition and Redox Behavior","Inorganic Chemistry","2010","49","","997","1007","10.1021/ic9019684","","","0.71073","MoKα","","0.1117","0.0643","","","0.1576","0.1953","","","","","","1.051","","","","has coordinates","264242","2021-04-16","08:52:17",""
"4315182","7.2852","0.0006","15.6714","0.0013","21.663","0.0018","90","","90","","90","","2473.2","0.4","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","Uranium Arsenate","","","- C H0 As0.5 F N O2 U0.5 -","- C As0.5 F N O2 U0.5 -","- C32 As16 F32 N32 O64 U16 -","32","1","","V. Koteswara Rao; K. Bharathi; Ramanath Prabhu; Manabendra Chandra; Srinivasan Natarajan","Two- and Three-Dimensional Open-Framework Uranium Arsenates: Synthesis, Structure, and Characterization","Inorganic Chemistry","2010","49","","2931","2947","10.1021/ic902472h","","","0.71073","MoKα","","0.0269","0.0222","","","0.0494","0.0518","","","","","","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4316369","44.0262","0.001","22.4503","0.0005","71.5704","0.0016","90","","90","","90","","70740","3","291","2","291","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C132 H96 F24 N16 P4 Pd4 -","- C132 H96 F24 N16 P4 Pd4 -","- C2112 H1536 F384 N256 P64 Pd64 -","16","0.5","","Guo-Hong Ning; Liao-Yuan Yao; Li-Xia Liu; Ting-Zheng Xie; Yi-Zhi Li; Yu Qin; Yuan-Jiang Pan; Shu-Yan Yu","Self-Assembly and Host-Guest Interaction of Metallomacrocycles Using Fluorescent Dipyrazole Linker with Dimetallic Clips","Inorganic Chemistry","2010","49","","7783","7792","10.1021/ic100724r","","","0.71073","MoKα","","0.0914","0.0488","","","0.0868","0.0934","","","","","","1.02","","","","has coordinates","179243","2020-10-21","18:00:00",""
"4316743","13.8325","0.0014","40.435","0.004","60.962","0.006","90","","90","","90","","34097","6","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C43 H21.33 Cu2 N2 O10 -","- C43 H21.3333 Cu2 N2 O10 -","- C1032 H512 Cu48 N48 O240 -","24","0.75","","Demin Liu; Zhigang Xie; Liqing Ma; Wenbin Lin","Three-Dimensional Metal-Organic Frameworks Based on Tetrahedral and Square-Planar Building Blocks: Hydrogen Sorption and Dye Uptake Studies","Inorganic Chemistry","2010","49","","9107","9109","10.1021/ic1009169","","","1.54178","CuKα","","0.138","0.0919","","","0.2426","0.263","","","","","","1.155","","","","has coordinates,has disorder","179247","2020-10-21","18:00:00",""
"4318504","9.248","0.004","19.982","0.007","35.093","0.016","90","","90","","90","","6485","5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Co(3-dpa)2(H2O)2(NO3)2 2(MeOH)","","","- C26 H20 Co N6 O10 -","- C26 H20 Co N6 O10 -","- C208 H160 Co8 N48 O80 -","8","0.25","","Md. Badruz Zaman; Mark D. Smith; Delia M. Ciurtin; Hans-Conrad zur Loye","New Cd(II)-, Co(II)-, and Cu(II)-Containing Coordination Polymers Synthesized by Using the Rigid Ligand 1,2-Bis(3-pyridyl)ethyne (3,3'-DPA)","Inorganic Chemistry","2002","41","","4895","4903","10.1021/ic011305x","","","0.71073","MoKα","","0.0632","0.0576","","","0.1638","0.17","","","","","","1.148","","","","has coordinates,has disorder","179265","2020-10-21","18:00:00",""
"4318589","7.4194","0.0006","17.963","0.002","24.574","0.002","90","","90","","90","","3275.1","0.5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C10 H20 Cd N6 O8 -","- C10 H20 Cd N6 O8 -","- C80 H160 Cd8 N48 O64 -","8","0.25","","R. Vaidhyanathan; Srinivasan Natarajan; C. N. R. Rao","Open-Framework Cadmium Succinates of Different Dimensionalities","Inorganic Chemistry","2002","41","","5226","5234","10.1021/ic020333s","","","0.71073","MoKα","","0.0152","0.015","","0.0369","0.0368","","","","1.134","1.139","1.139","","","","","has coordinates","179265","2020-10-21","18:00:00",""
"4319429","8.9252","0.0015","8.9686","0.0015","11.2062","0.0019","90","","90","","90","","897","0.3","153","2","153","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Au Li S -","- Au Li S -","- Au16 Li16 S16 -","16","0.5","","Fu Qiang Huang; Yuting Yang; Christine Flaschenriem; James A. Ibers","Syntheses and Structures of LiAuS and Li3AuS2","Inorganic Chemistry","2001","40","","1397","1398","10.1021/ic001275i","","","0.71073","MoKα","","0.035","0.027","","","0.0663","0.0683","","","","","","1.197","","","","has coordinates","179274","2020-10-21","18:00:00",""
"4320388","5.342","0.001","17.078","0.003","29.469","0.004","90","","90","","90","","2688.5","0.8","293","2","293","2","","","","","","","aqueous synthesis","5","F d d d :2","-F 2uv 2vw","70","","catena-(mu-oxalato)-bis(4-aminopyridine)-nickel(II)","","- C12 H12 N4 Ni O4 -","- C12 H12 N4 Ni O4 -","- C96 H96 N32 Ni8 O32 -","8","0.25","","Oscar Castillo; Antonio Luque; Pascual Román; Francesc Lloret; Miguel Julve","Syntheses, Crystal Structures, and Magnetic Properties of One-Dimensional Oxalato-Bridged Co(II), Ni(II), and Cu(II) Complexes withn-Aminopyridine (n= 2-4) as Terminal Ligand","Inorganic Chemistry","2001","40","","5526","5535","10.1021/ic0103401","","","0.71069","MoKα","","0.2371","0.0636","","0.1899","0.1545","","","","0.856","1.168","1.168","","","","","has coordinates","179306","2020-10-21","18:00:00",""
"4320389","5.663","0.001","16.589","0.002","29.125","0.007","90","","90","","90","","2736.1","0.9","293","2","293","2","","","","","","","aqueous synthesis","5","F d d d :2","-F 2uv 2vw","70","","catena-(mu-oxalato)-bis(4-aminopyridine)-copper(II)","","- C12 H12 Cu N4 O4 -","- C12 H12 Cu N4 O4 -","- C96 H96 Cu8 N32 O32 -","8","0.25","","Oscar Castillo; Antonio Luque; Pascual Román; Francesc Lloret; Miguel Julve","Syntheses, Crystal Structures, and Magnetic Properties of One-Dimensional Oxalato-Bridged Co(II), Ni(II), and Cu(II) Complexes withn-Aminopyridine (n= 2-4) as Terminal Ligand","Inorganic Chemistry","2001","40","","5526","5535","10.1021/ic0103401","","","0.71069","MoKα","","0.0481","0.041","","0.1076","0.1051","","","","1.149","1.219","1.219","","","","","has coordinates","179306","2020-10-21","18:00:00",""
"4321757","16.768","0.002","21.617","0.002","10.929","0.002","90","","90","","90","","3961.5","0.9","296.2","","296.2","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C8 H7 Rb S2 -","- C8 H7 Rb S2 -","- C128 H112 Rb16 S32 -","16","0.5","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","0","0","","0.1086","0","0.0367","","","2.088","","","1.468","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321758","17.346","0.001","21.891","0.002","10.931","0.002","90","","90","","90","","4150.7","0.9","173.2","","173.2","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C8 H7 Cs S2 -","- C8 H7 Cs S2 -","- C128 H112 Cs16 S32 -","16","0.5","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","0","0","","","0","0.0322","","","","","","1.463","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321974","25.252","0.065","26.752","0.012","28.567","0.042","90","","90","","90","","19298","6","213","2","213","2","","","","","","","synthesis","5","F d d d :2","-F 2uv 2vw","70","","","","- C52 H36 Cr2 F8 N8 -","- C52 H36 Cr2 F8 N8 -","- C832 H576 Cr32 F128 N128 -","16","0.5","","F. Albert Cotton; Carlos A. Murillo; Isabel Pascual","Quadruply Bonded Dichromium Complexes with Variously Fluorinated Formamidinate Ligands","Inorganic Chemistry","1999","38","","2182","2187","10.1021/ic990007l","","","0.71073","MoKα","","0.1052","0.094","","0.2585","0.2466","","","","1.152","1.214","1.214","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4324671","23.522","0.003","28.077","0.004","36.438","0.005","90","","90","","90","","24065","6","150.1","","","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C36 H42 Co La N6 O24 -","- C36 H18 Co La N6 O24 -","- C576 H288 Co16 La16 N96 O384 -","16","0.5","","Atsushi Kobayashi; Yui Suzuki; Tadashi Ohba; Shin-ichiro Noro; Ho-Chol Chang; Masako Kato","Ln-Co-Based Rock-Salt-Type Porous Coordination Polymers: Vapor Response Controlled by Changing the Lanthanide Ion","Inorganic Chemistry","2011","50","","2061","2063","10.1021/ic102361d","","","0.7107","MoKα","","","0.0746","","","","0.292","","","","","","1.062","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4325408","5.6011","0.0007","12.0323","0.0017","26.525","0.004","90","","90","","90","","1787.6","0.4","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- H8 O12 Pu S2 -","- O12 Pu S2 -","- O96 Pu8 S16 -","8","0.25","","Richard E. Wilson","Structural Periodicity in Plutonium(IV) Sulfates","Inorganic Chemistry","2011","50","","5663","5670","10.1021/ic200384h","","","0.71073","MoKα","","0.0207","0.0189","","","0.0487","0.0495","","","","","","1.181","","","","has coordinates","179357","2020-10-21","18:00:00",""
"4325487","13.493","0.002","28.102","0.005","29.703","0.005","90","","90","","90","","11263","3","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C29 H29 Fe N3 O2 -","- C29 H29 Fe N3 O2 -","- C464 H464 Fe16 N48 O32 -","16","0.5","","Timothy J. Boyle; Leigh Anna M. Ottley; Christopher A. Apblett; Constantine A. Stewart; Sarah M. Hoppe; Krista L. Hawthorne; Mark A. Rodriguez","Synthesis, Characterization, and Electrochemical Properties of a Series of Sterically Varied Iron(II) Alkoxide Precursors and Their Resultant Nanoparticles","Inorganic Chemistry","2011","50","","6174","6182","10.1021/ic200423m","","","0.71073","MoKα","","0.069","0.0587","","","0.1237","0.129","","","","","","1.213","","","","has coordinates","179357","2020-10-21","18:00:00",""
"4325739","22.947","0.005","31.395","0.006","32.718","0.007","90","","90","","90","","23571","8","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C80 H152 Cl2 N48 Na2 O56 -","- C80 H88 Cl2 N48 Na2 O32 -","- C640 H704 Cl16 N384 Na16 O256 -","8","0.25","","Wen-Jian Chen; Da-Hai Yu; Xin Xiao; Yun-Qian Zhang; Qian-Jiang Zhu; Sai-Feng Xue; Zhu Tao; Gang Wei","Difference of Coordination between Alkali- and Alkaline-Earth-Metal Ions to a Symmetrical α,α',δ,δ'-Tetramethylcucurbit[6]uril","Inorganic Chemistry","2011","50","","6956","6964","10.1021/ic200109s","","","0.71073","MoKα","","0.1081","0.0787","","","0.2197","0.235","","","","","","1.045","","","","has coordinates","179360","2020-10-21","18:00:00",""
"4325740","23.0629","0.0016","31.7424","0.0016","32.528","0.003","90","","90","","90","","23813","3","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C40 H72 Br2 N24 Na O25.5 -","- C40 H44 Br2 N24 Na O19 -","- C640 H704 Br32 N384 Na16 O304 -","16","0.5","","Wen-Jian Chen; Da-Hai Yu; Xin Xiao; Yun-Qian Zhang; Qian-Jiang Zhu; Sai-Feng Xue; Zhu Tao; Gang Wei","Difference of Coordination between Alkali- and Alkaline-Earth-Metal Ions to a Symmetrical α,α',δ,δ'-Tetramethylcucurbit[6]uril","Inorganic Chemistry","2011","50","","6956","6964","10.1021/ic200109s","","","0.71073","MoKα","","0.1243","0.0861","","","0.267","0.2914","","","","","","1.047","","","","has coordinates,has disorder","289268","2024-02-02","08:58:43",""
"4325741","22.0717","0.0017","31.444","0.003","32.9292","0.0017","90","","90","","90","","22854","3","273","2","273","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C80 H124 Cl6 K4 N48 O41 -","- C80 H88 Cl6 K4 N48 O33 -","- C640 H704 Cl48 K32 N384 O264 -","8","0.25","","Wen-Jian Chen; Da-Hai Yu; Xin Xiao; Yun-Qian Zhang; Qian-Jiang Zhu; Sai-Feng Xue; Zhu Tao; Gang Wei","Difference of Coordination between Alkali- and Alkaline-Earth-Metal Ions to a Symmetrical α,α',δ,δ'-Tetramethylcucurbit[6]uril","Inorganic Chemistry","2011","50","","6956","6964","10.1021/ic200109s","","","0.71073","MoKα","","0.0874","0.0781","","","0.2455","0.2555","","","","","","1.074","","","","has coordinates,has disorder","179360","2020-10-21","18:00:00",""
"4325742","22.0414","0.0017","31.67","0.003","32.949","0.0017","90","","90","","90","","23000","3","223","2","223","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C40 H61 Br2 Cl K2 N24 O20 -","- C40 H44 Br2 Cl K2 N24 O20 -","- C640 H704 Br32 Cl16 K32 N384 O320 -","16","0.5","","Wen-Jian Chen; Da-Hai Yu; Xin Xiao; Yun-Qian Zhang; Qian-Jiang Zhu; Sai-Feng Xue; Zhu Tao; Gang Wei","Difference of Coordination between Alkali- and Alkaline-Earth-Metal Ions to a Symmetrical α,α',δ,δ'-Tetramethylcucurbit[6]uril","Inorganic Chemistry","2011","50","","6956","6964","10.1021/ic200109s","","","0.71073","MoKα","","0.1027","0.0849","","","0.2652","0.2774","","","","","","1.081","","","","has coordinates,has disorder","179360","2020-10-21","18:00:00",""
"4325745","22.291","0.006","31.654","0.009","32.854","0.009","90","","90","","90","","23182","11","223","2","223","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C40 H59 Cl4 K N24 O19 Rb2 -","- C40 H44 Cl4 K N24 O19 Rb2 -","- C640 H704 Cl64 K16 N384 O304 Rb32 -","16","0.5","","Wen-Jian Chen; Da-Hai Yu; Xin Xiao; Yun-Qian Zhang; Qian-Jiang Zhu; Sai-Feng Xue; Zhu Tao; Gang Wei","Difference of Coordination between Alkali- and Alkaline-Earth-Metal Ions to a Symmetrical α,α',δ,δ'-Tetramethylcucurbit[6]uril","Inorganic Chemistry","2011","50","","6956","6964","10.1021/ic200109s","","","0.71073","MoKα","","0.1896","0.096","","","0.2788","0.3195","","","","","","1.021","","","","has coordinates,has disorder","179360","2020-10-21","18:00:00",""
"4326340","12.6621","0.0017","16.885","0.002","25.449","0.004","90","","90","","90","","5441","1.3","100","0.1","100","0.1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","jonsk12","Ni(PONOPONOP)","","- C26 H42 N2 Ni O4 P2 -","- C26 H42 N2 Ni O4 P2 -","- C208 H336 N16 Ni8 O32 P16 -","8","0.25","","Sabuj Kundu; William W. Brennessel; William D. Jones","Synthesis and Reactivity of New Ni, Pd, and Pt 2,6-Bis(di-tert-butylphosphinito)pyridine Pincer Complexes","Inorganic Chemistry","2011","50","","9443","9453","10.1021/ic201102v","","","0.71073","MoKα","","0.1147","0.0767","","","0.1722","0.1858","","","","","","1.146","","","","has coordinates,has disorder","179366","2020-10-21","18:00:00",""
"4326804","8.75292","0.00004","20.7551","0.00005","34.35779","0.00008","90","","90","","90","","6241.7","0.04","250","","250","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C12 O6 Sc -","- C12 O6 Sc -","- C192 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.826019","","","","","","","","","0.11821","","1.21","","","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4326805","8.742107","0.000014","20.739628","0.000027","34.34945","0.00004","90","","90","","90","","6227.83","0.015","323","","323","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C12 O6 Sc -","- C12 O6 Sc -","- C192 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.825028","","","","","","","","","0.10726","","5.24","","","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4326806","8.73461","0.000015","20.733114","0.000025","34.35274","0.00004","90","","90","","90","","6221.13","0.015","373","","373","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C12 O6 Sc -","- C12 O6 Sc -","- C192 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.825028","","","","","","","","","0.10124","","5.2","","","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4326807","8.725487","0.000017","20.728004","0.000023","34.35838","0.00004","90","","90","","90","","6214.12","0.016","423","","423","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C12 O6 Sc -","- C12 O6 Sc -","- C192 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.825028","","","","","","","","","0.10027","","5.03","","","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4326808","8.715763","0.000022","20.722986","0.000026","34.36496","0.00004","90","","90","","90","","6206.88","0.019","473","","473","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C12 O6 Sc -","- C12 O6 Sc -","- C192 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.825028","","","","","","","","","0.1084","","5.27","","","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4326809","8.704711","0.000032","20.71887","0.000031","34.37361","0.00006","90","","90","","90","","6199.34","0.03","523","","523","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C12 O6 Sc -","- C12 O6 Sc -","- C192 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.825028","","","","","","","","","0.10853","","5.61","","","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4326810","8.72068","0.00016","20.82072","0.00017","34.3857","0.00028","90","","90","","90","","6243.44","0.14","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 N1.5 O6 Sc -","- C12 N1.5 O6 Sc -","- C192 N24 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.826019","","","","","","","","","0.19202","","4.91","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4326811","8.6995","0.0004","20.8176","0.0008","34.3571","0.0012","90","","90","","90","","6222.2","0.4","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 N1.5 O6 Sc -","- C12 N1.5 O6 Sc -","- C192 N24 O96 Sc16 -","16","0.5","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","1.54056","","","","","","","","","0.1462","","1.22","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4329568","28.645","0.009","31.827","0.011","38.707","0.013","90","","90","","90","","35289","2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- H30 K14 O84 P2 W19 -","- K10 O84 P2 W19 -","- K160 O1344 P32 W304 -","16","0.5","","Kevin P. O'Halloran; Chongchao Zhao; Nicole S. Ando; Arthur J. Schultz; Thomas F. Koetzle; Paula M. B. Piccoli; Britt Hedman; Keith O. Hodgson; Elena Bobyr; Martin L. Kirk; Sushilla Knottenbelt; Ezra C. Depperman; Benjamin Stein; Travis M. Anderson; Rui Cao; Yurii V. Geletii; Kenneth I. Hardcastle; Djamaladdin G. Musaev; Wade A. Neiwert; Xikui Fang; Keiji Morokuma; Shaoxiong Wu; Paul Kögerler; Craig L. Hill","Revisiting the Polyoxometalate-Based Late-Transition-Metal-Oxo Complexes: The ""Oxo Wall"" Stands","Inorganic Chemistry","2012","51","","7025","7031","10.1021/ic2008914","","","0.71073","MoKα","","0.0675","0.0497","","","0.1844","0.2129","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4330248","11.6083","0.0008","40.268","0.003","48.394","0.003","90","","90","","90","","22621","3","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C57 H64 Mn4 N4 O18 -","- C57 H64 Mn4 N4 O18 -","- C912 H1024 Mn64 N64 O288 -","16","0.5","","Lu-Fang Ma; Min-Le Han; Jian-Hua Qin; Li-Ya Wang; Miao Du","MnIICoordination Polymers Based on Bi-, Tri-, and Tetranuclear and Polymeric Chain Building Units: Crystal Structures and Magnetic Properties","Inorganic Chemistry","2012","51","","9431","9442","10.1021/ic3012537","","","0.71073","MoKα","","0.0512","0.0435","","","0.1584","0.1745","","","","","","1.028","","","","has coordinates,has disorder","179405","2020-10-21","18:00:00",""
"4330834","5.88982","0.00005","8.46873","0.00006","17.68254","0.00015","90","","90","","90","","881.993","0.012","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Li2.71 Mg2.29 O6 Os -","- Li2.711 Mg2.289 O6 Os -","- Li21.688 Mg18.312 O48 Os8 -","8","0.25","","Phuong-Hieu T. Nguyen; Farshid Ramezanipour; John E. Greedan; Lachlan M. D. Cranswick; Shahab Derakhshan","Synthesis, Crystal Structure, and Magnetic Properties of Li3Mg2OsO6, a Geometrically Frustrated Osmium(V) Oxide with an Ordered Rock Salt Structure: Comparison with Isostructural Li3Mg2RuO6","Inorganic Chemistry","2012","51","","11493","11499","10.1021/ic3013377","powder diffraction","x-ray","1.54059","","","","","","","","","0.04363","","1.49","","","","","","","has coordinates,has Fobs","179411","2020-10-21","18:00:00",""
"4331429","11.725","","13.004","","6.286","","90","","90","","90","","958.438","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Ba Be2 (B O3)2","","- B2 Ba Be2 O6 -","- B2 Ba Be2 O6 -","- B16 Ba8 Be16 O48 -","8","0.25","","Keszler, D.A.; Schaffers, K.I.","Tetrahedral triangular 3-D framework and europium luminescence in the borate BaBe2(BO3)2","Inorganic Chemistry","1994","33","","1201","1204","10.1021/ic00084a038","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331786","22.6535","0.0017","37.36","0.003","46.159","0.003","90","","90","","90","","39066","5","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","1-Gd","","","- C122 H190 Gd6 Mn12 N8 O88 -","- C116 H140 Gd6 Mn12 N8 O69 -","- C928 H1120 Gd48 Mn96 N64 O552 -","8","0.25","","Jun-Liang Liu; Wei-Quan Lin; Yan-Cong Chen; Ji-Dong Leng; Fu-Sheng Guo; Ming-Liang Tong","Symmetry-Related [LnIII6MnIII12] Clusters toward Single-Molecule Magnets and Cryogenic Magnetic Refrigerants","Inorganic Chemistry","2013","52","","457","463","10.1021/ic302349f","","","0.71073","MoKα","","0.1099","0.0644","","","0.1684","0.198","","","","","","1.033","","","","has coordinates,has disorder","179420","2020-10-21","18:00:00",""
"4331788","22.837","0.0007","37.3301","0.0012","46.178","0.0015","90","","90","","90","","39367","2","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C123 H194 Mn12 N8 O89 Tb6 -","- C116 H140 Mn12 N8 O69 Tb6 -","- C928 H1120 Mn96 N64 O552 Tb48 -","8","0.25","","Jun-Liang Liu; Wei-Quan Lin; Yan-Cong Chen; Ji-Dong Leng; Fu-Sheng Guo; Ming-Liang Tong","Symmetry-Related [LnIII6MnIII12] Clusters toward Single-Molecule Magnets and Cryogenic Magnetic Refrigerants","Inorganic Chemistry","2013","52","","457","463","10.1021/ic302349f","","","0.71073","MoKα","","0.1117","0.062","","","0.1397","0.1577","","","","","","1.007","","","","has coordinates,has disorder","179420","2020-10-21","18:00:00",""
"4332178","9.0606","0.0006","15.7587","0.0008","32.0453","0.0016","90","","90","","90","","4575.5","0.4","273","2","273","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C8 H28 N2 O12 P4 Zn3 -","- C8 H28 N2 O12 P4 Zn3 -","- C64 H224 N16 O96 P32 Zn24 -","8","0.25","","Chen, Lan; Bu, Xianhui","(3,4)-Connected Zincophosphites as Structural Analogues of Zinc Hydrogen Phosphate","Inorganic Chemistry","2006","45","12","4654","4660","10.1021/ic060059s","","","0.71073","MoKα","","0.0458","0.0359","","","0.1052","0.1074","","","","","","1.068","","","","has coordinates","179424","2020-10-21","18:00:00",""
"4332237","19.4287","0.0007","36.4741","0.0012","42.9932","0.0015","90","","90","","90","","30466.9","1.8","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C156 H120 Ag4 Cl12 O16 P8 -","- C156 H120 Ag4 Cl12 O16 P8 -","- C1248 H960 Ag32 Cl96 O128 P64 -","8","0.25","","Lin, Ronger; Yip, John H. K.","Self-Assembly, Structures, and Solution Dynamics of Emissive Silver Metallacycles and Helices","Inorganic Chemistry","2006","45","11","4423","4430","10.1021/ic060140v","","","0.71073","MoKα","","0.11","0.0843","","","0.2108","0.2263","","","","","","1.087","","","","has coordinates,has disorder","179425","2020-10-21","18:00:00",""
"4332832","24.091","0.001","34.462","0.002","9.065","0.0005","90","","90","","90","","7526","0.7","233.2","","","","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C30 H36 Cu F12 N4 O2 P2 -","- C30 H36 Cu F12 N4 O2 P2 -","- C240 H288 Cu8 F96 N32 O16 P16 -","8","0.25","","Noro, Shin-ichiro; Horike, Satoshi; Tanaka, Daisuke; Kitagawa, Susumu; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Flexible and Shape-Selective Guest Binding at CuIIAxial Sites in 1-Dimensional CuII−1,2-Bis(4-pyridyl)ethane Coordination Polymers","Inorganic Chemistry","2006","45","23","9290","9300","10.1021/ic0609249","","","0.7107","MoKα","","","0.0646","","","","0.0927","","","","","","1.9","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333602","8.475","0.002","14.725","0.002","66.445","0.002","90","","90","","90","","8292","2","298","2","298","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Ba36 Ge240 Rh108 -","- Ba40 Ge285.728 Rh120 -","- Ba40 Ge285.728 Rh120 -","1","0.03125","","M. Falmbigl; F. Kneidinger; M. Chen; A. Grytsiv; H. Michor; E. Royanian; E. Bauer; H. Effenberger; R. Podloucky; P. Rogl","Cage-Forming Compounds in the Ba-Rh-Ge System: From Thermoelectrics to Superconductivity","Inorganic Chemistry","2013","52","","931","943","10.1021/ic302139r","","","0.71069","MoKα","","0.0747","0.034","","","0.0477","0.0554","","","","","","1.014","","","","has coordinates","179439","2020-10-21","18:00:00",""
"4333713","11.012","0.005","12.403","0.005","15.839","0.007","90","","90","","90","","2163.3","1.6","296","2","296","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Mo O6 P Rb -","- Mo O6 P Rb -","- Mo16 O96 P16 Rb16 -","16","0.5","","Ying Wang; Shilie Pan; Xin Su; Zhihua Yang; Lingyun Dong; Min Zhang","New Molybdenum(VI) Phosphates: Synthesis, Characterization, and Calculations of Centrosymmetric RbMoO2PO4 and Noncentrosymmetric Rb4Mo5P2O22","Inorganic Chemistry","2013","52","","1488","1495","10.1021/ic302246c","","","0.71073","MoKα","","0.0253","0.0227","","","0.061","0.0623","","","","","","1.17","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4334989","12.8161","0.0019","27.136","0.004","35.312","0.005","90","","90","","90","","12281","3","250","2","250","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C29 H18 Co F12 N4 -","- C29 H17.5 Co F12 N4 -","- C464 H280 Co16 F192 N64 -","16","0.5","","Keith Searles; Atanu K. Das; René W. Buell; Maren Pink; Chun-Hsing Chen; Kuntal Pal; David Gene Morgan; Daniel J. Mindiola; Kenneth G. Caulton","Correction to 2,2'-Pyridylpyrrolide Ligand Redistribution Following Reduction","Inorganic Chemistry","2013","52","","6231","6231","10.1021/ic401081m","","","0.71073","MoKα","","0.0669","0.0488","","","0.1363","0.1525","","","","","","1.056","","","","has coordinates,has disorder","179452","2020-10-21","18:00:00",""
"4335202","6.5171","0.0016","8.867","0.002","21.844","0.005","90","","90","","90","","1262.3","0.5","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Au2 Ba P4 -","- Au2 Ba P4 -","- Au16 Ba8 P32 -","8","0.25","","James Fulmer; Derrick C. Kaseman; Juli-Anna Dolyniuk; Kathleen Lee; Sabyasachi Sen; Kirill Kovnir","BaAu2P4: Layered Zintl Polyphosphide with Infinite \ιnfty1(P-) Chains","Inorganic Chemistry","2013","52","","7061","7067","10.1021/ic400584w","","","0.71073","MoKα","","0.0171","0.0151","","","0.033","0.0335","","","","","","1.075","","","","has coordinates","179455","2020-10-21","18:00:00",""
"4335369","16.308","0.004","28.828","0.007","39.028","0.01","90","","90","","90","","18348","8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C18 H18 Eu N0.5 O10 -","- C18 H7 Eu N0.5 O10 -","- C576 H224 Eu32 N16 O320 -","32","1","","Yan-Li Gai; Fei-Long Jiang; Lian Chen; Yang Bu; Kong-Zhao Su; Shaeel A. Al-Thabaiti; Mao-Chun Hong","Photophysical Studies of Europium Coordination Polymers Based on a Tetracarboxylate Ligand","Inorganic Chemistry","2013","52","","7658","7665","10.1021/ic400777c","","","0.71073","MoKα","","0.0341","0.0319","","","0.0822","0.084","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4335397","8.921","0.003","15.198","0.004","30.104","0.009","90","","90","","90","","4082","2","296","2","296","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- P0.67 S2.33 U0.33 -","- P0.666667 S2.33333 U0.333333 -","- P32 S112 U16 -","48","1.5","","Jean-Marie Babo; Laurent Jouffret; Jian Lin; Eric M. Villa; Thomas E. Albrecht-Schmitt","Synthesis, Structure, and Spectroscopy of Two Ternary Uranium(IV) Thiophosphates: UP2S9 and UP2S7 Containing P2S92- and P2S72- Ligands","Inorganic Chemistry","2013","52","","7747","7751","10.1021/ic400942r","","","0.71073","MoKα","","0.0298","0.0219","","","0.0363","0.0384","","","","","","1.044","","","","has coordinates","179456","2020-10-21","18:00:00",""
"4335812","8.7069","0.0017","15.011","0.003","17.761","0.004","90","","90","","90","","2321.3","0.8","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Ag1.22 Eu2 Ge2.78 -","- Ag1.224 Eu2 Ge2.776 -","- Ag19.584 Eu32 Ge44.416 -","16","0.5","","Sumanta Sarkar; Sebastian C. Peter","Structural Phase Transitions in a New Compound Eu2AgGe3","Inorganic Chemistry","2013","52","","9741","9748","10.1021/ic400369a","","","0.71073","MoKα","","0.0909","0.0769","","","0.1716","0.179","","","","","","1.424","","","","has coordinates","179461","2020-10-21","18:00:00",""
"4336762","14.6209","0.0004","15.5436","0.0005","25.623","0.0008","90","","90","","90","","5823.1","0.3","123","1","123","1","","","","","","","see text","5","F d d d :2","-F 2uv 2vw","70","","","","- C20 H20 Br6 In2 N4 -","- C20 H20 Br6 In2 N4 -","- C160 H160 Br48 In16 N32 -","8","0.25","","Igor V. Kazakov; Michael Bodensteiner; Anna S. Lisovenko; Andrew V. Suvorov; Manfred Scheer; Gábor Balázs; Alexey Y. Timoshkin","Structures and Stability of Molecular InBr3Pyx (x= 1-3) Complexes: Unexpected Solid State Stabilization of Dimeric In2Br6Py4As Compared to Valence-Isoelectronic Group 15 and 17 Halogen Bridging Dimers","Inorganic Chemistry","2013","52","","13207","13215","10.1021/ic402162d","","x-ray","1.54178","CuKα","","0.0405","0.0363","","","0.0984","0.1027","","","","","","1.179","","","","has coordinates","179470","2020-10-21","18:00:00",""
"4337951","23.1443","0.0002","29.482","0.003","32.219","0.002","90","","90","","90","","21984","3","100","","100","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C114 H130 Cl6 Dy N16 S8 -","- C114 H130 Cl6 Dy N16 S8 -","- C912 H1040 Cl48 Dy8 N128 S64 -","8","0.25","","Ayhan, Mehmet Menaf; Singh, Anu; Jeanneau, Erwann; Ahsen, Vefa; Zyss, Joseph; Ledoux-Rak, Isabelle; Gürek, Ayşe Gül; Hirel, Catherine; Bretonnière, Yann; Andraud, Chantal","ABAB Homoleptic Bis(phthalocyaninato)lanthanide(III) Complexes: Original Octupolar Design Leading to Giant Quadratic Hyperpolarizability.","Inorganic chemistry","2014","53","9","4359","4370","10.1021/ic4031188","","","0.7107","MoKα","","0.0675","0.0545","","0.1269","0.108","0.1269","","","","","","0.9351","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4337952","23.186","0.001","29.276","0.002","32.081","0.002","90","","90","","90","","21776","2","100","","100","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C114 H130 Cl6 N16 S8 Y -","- C114 H130 Cl6 N16 S8 Y -","- C912 H1040 Cl48 N128 S64 Y8 -","8","0.25","","Ayhan, Mehmet Menaf; Singh, Anu; Jeanneau, Erwann; Ahsen, Vefa; Zyss, Joseph; Ledoux-Rak, Isabelle; Gürek, Ayşe Gül; Hirel, Catherine; Bretonnière, Yann; Andraud, Chantal","ABAB Homoleptic Bis(phthalocyaninato)lanthanide(III) Complexes: Original Octupolar Design Leading to Giant Quadratic Hyperpolarizability.","Inorganic chemistry","2014","53","9","4359","4370","10.1021/ic4031188","","","0.7107","MoKα","","0.0976","0.0788","","0.2229","0.1739","0.2229","","","","","","0.9887","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4337953","23.275","0.001","29.404","0.001","32.015","0.002","90","","90","","90","","21910.4","1.8","100","","100","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C114 H130 Cl6 N16 Nd S8 -","- C114 H130 Cl6 N16 Nd S8 -","- C912 H1040 Cl48 N128 Nd8 S64 -","8","0.25","","Ayhan, Mehmet Menaf; Singh, Anu; Jeanneau, Erwann; Ahsen, Vefa; Zyss, Joseph; Ledoux-Rak, Isabelle; Gürek, Ayşe Gül; Hirel, Catherine; Bretonnière, Yann; Andraud, Chantal","ABAB Homoleptic Bis(phthalocyaninato)lanthanide(III) Complexes: Original Octupolar Design Leading to Giant Quadratic Hyperpolarizability.","Inorganic chemistry","2014","53","9","4359","4370","10.1021/ic4031188","","","0.7107","MoKα","","0.1007","0.0864","","0.2057","0.1748","0.2057","","","","","","0.8431","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4337954","23.289","0.001","29.342","0.002","31.977","0.001","90","","90","","90","","21851.3","1.9","100","","100","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C114 H130 Cl6 Eu N16 S8 -","- C114 H130 Cl6 Eu N16 S8 -","- C912 H1040 Cl48 Eu8 N128 S64 -","8","0.25","","Ayhan, Mehmet Menaf; Singh, Anu; Jeanneau, Erwann; Ahsen, Vefa; Zyss, Joseph; Ledoux-Rak, Isabelle; Gürek, Ayşe Gül; Hirel, Catherine; Bretonnière, Yann; Andraud, Chantal","ABAB Homoleptic Bis(phthalocyaninato)lanthanide(III) Complexes: Original Octupolar Design Leading to Giant Quadratic Hyperpolarizability.","Inorganic chemistry","2014","53","9","4359","4370","10.1021/ic4031188","","","0.7107","MoKα","","0.0798","0.0665","","0.1272","0.1096","0.1272","","","","","","1.068","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4338158","14.521","0.005","27.079","0.005","32.807","0.005","90","0.005","90","0.005","90","0.005","12900","5","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C34 H26 F6 Fe N10 P -","- C34 H26 F6 Fe N10 P -","- C544 H416 F96 Fe16 N160 P16 -","16","0.5","","Ghosh, Pradip; Samanta, Subhas; Roy, Suman K.; Demeshko, Serhiy; Meyer, Franc; Goswami, Sreebrata","Introducing a new azoaromatic pincer ligand. Isolation and characterization of redox events in its ferrous complexes.","Inorganic chemistry","2014","53","9","4678","4686","10.1021/ic500355f","","","0.71073","MoKα","","0.0481","0.0362","","","0.1056","0.1339","","","","","","0.779","","","","has coordinates","179484","2020-10-21","18:00:00",""
"4338352","11.8607","0.0016","50.637","0.007","61.215","0.008","90","","90","","90","","36765","9","296","2","296","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C12 H103 Mo24 N4 Na5 O138 P12 -","- C12 H24 Mo24 N4 Na5 O138 P12 -","- C96 H192 Mo192 N32 Na40 O1104 P96 -","8","0.25","","Yang, Lu; Ma, Pengtao; Zhou, Zhen; Wang, Jingping; Niu, Jingyang","A crown-shaped 24-molybdate cluster constructed by organotriphosphonate ligand.","Inorganic chemistry","2013","52","15","8285","8287","10.1021/ic400848r","","","0.71073","MoKα","","0.0767","0.0592","","","0.1756","0.1908","","","","","","1.065","","","","has coordinates,has disorder","179486","2020-10-21","18:00:00",""
"4340402","14.486","0.005","21.824","0.005","24.041","0.005","90","0.005","90","0.005","90","0.005","7600","4","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C32 H26 Ag4 N8 O14 S4 -","- C32 H26 Ag4 N8 O14 S4 -","- C256 H208 Ag32 N64 O112 S32 -","8","0.25","","Li, Fang-Fang; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Influence of neutral ligands on the structures of silver(I) sulfonates.","Inorganic chemistry","2005","44","25","9374","9383","10.1021/ic050984z","","","0.71069","MoKα","","0.0484","0.0398","","","0.1172","0.13","","","","","","1.043","","","","has coordinates","179507","2020-10-21","18:00:00",""
"4340786","10.358","0.003","44.783","0.012","69.995","0.016","90","","90","","90","","32468","15","113","2","113","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C24 H23 N2 O6 P Zn -","- C24 H23 N2 O6 P Zn -","- C768 H736 N64 O192 P32 Zn32 -","32","1","","Kalita, Alok Ch; Gogoi, Nayanmoni; Jangir, Ritambhara; Kuppuswamy, Subramaniam; Walawalkar, Mrinalini G.; Murugavel, Ramaswamy","Ab initio chemical synthesis of designer metal phosphate frameworks at ambient conditions.","Inorganic chemistry","2014","53","17","8959","8969","10.1021/ic500810d","","","0.71075","MoKα","","0.1307","0.0995","","","0.2876","0.323","","","","","","1.085","","","","has coordinates,has disorder","179510","2020-10-21","18:00:00",""
"4341195","7.0425","0.0003","12.3268","0.0004","18.2185","0.0005","90","","90","","90","","1581.58","0.1","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","Sodium Thorium Arsenate","","","- As2 Na2 O8 Th -","- As2 Na2 O8 Th -","- As16 Na16 O64 Th8 -","8","0.25","","Yu, Na; Klepov, Vladislav V.; Modolo, Giuseppe; Bosbach, Dirk; Suleimanov, Evgeny V.; Gesing, Thorsten M.; Robben, Lars; Alekseev, Evgeny V.","Morphotropy and Temperature-Driven Polymorphism in A2Th(AsO4)2 (A = Li, Na, K, Rb, Cs) Series.","Inorganic chemistry","2014","53","20","11231","11241","10.1021/ic5018246","","","0.71073","MoKα","","0.0185","0.0144","","","0.0264","0.0273","","","","","","1.071","","","","has coordinates","179514","2020-10-21","18:00:00",""
"4342525","23.42","0.007","28.043","0.008","36.241","0.01","90","","90","","90","","23802","12","150","","150","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C36 H70 Ce Co N6 O38 -","- C36 H18 Ce Co N6 O38 -","- C576 H288 Ce16 Co16 N96 O608 -","16","0.5","","Kobayashi, Atsushi; Suzuki, Yui; Ohba, Tadashi; Ogawa, Tomohiro; Matsumoto, Takeshi; Noro, Shin-Ichiro; Chang, Ho-Chol; Kato, Masako","Systematic Syntheses and Metalloligand Doping of Flexible Porous Coordination Polymers Composed of a Co(III)-Metalloligand.","Inorganic chemistry","2015","54","6","2522","2535","10.1021/ic5021302","","","0.7107","MoKα","","","0.0832","","","","0.1569","","","","","","1.316","","","","has coordinates","179528","2020-10-21","18:00:00",""
"4342526","23.316","0.005","28.011","0.006","36.079","0.007","90","","90","","90","","23563","8","150","","150","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C36 H62 Co N6 O34 Pr -","- C36 H18 Co N6 O34 Pr -","- C576 H288 Co16 N96 O544 Pr16 -","16","0.5","","Kobayashi, Atsushi; Suzuki, Yui; Ohba, Tadashi; Ogawa, Tomohiro; Matsumoto, Takeshi; Noro, Shin-Ichiro; Chang, Ho-Chol; Kato, Masako","Systematic Syntheses and Metalloligand Doping of Flexible Porous Coordination Polymers Composed of a Co(III)-Metalloligand.","Inorganic chemistry","2015","54","6","2522","2535","10.1021/ic5021302","","","0.6889","","","","0.0709","","","","0.2579","","","","","","1.135","","","","has coordinates","179528","2020-10-21","18:00:00",""
"4347706","11.112","0.007","36.81","0.02","61.22","0.04","90","","90","","90","","25041","3","120","2","120","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C94 H116 Dy4 N28 O36 -","- C94 H72 Dy4 N28 O36 -","- C752 H576 Dy32 N224 O288 -","8","0.25","","Huang, Wei; Shen, Fu-Xing; Wu, Shu-Qi; Liu, Li; Wu, Dayu; Zheng, Zhe; Xu, Jun; Zhang, Ming; Huang, Xing-Cai; Jiang, Jun; Pan, Feifei; Li, Yao; Zhu, Kun; Sato, Osamu","Metallogrid Single-Molecule Magnet: Solvent-Induced Nuclearity Transformation and Magnetic Hysteresis at 16 K.","Inorganic chemistry","2016","55","11","5476","5484","10.1021/acs.inorgchem.6b00500","","","0.71073","MoKα","","0.1613","0.0973","","","0.2635","0.3083","","","","","","1","","","","has coordinates","232455","2020-10-21","18:00:00",""
"4348630","21.844","0.004","22.269","0.005","30.321","0.006","90","","90","","90","","14749","5","123","2","123","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C90 H59 Cl6 La N8 -","- C90 H56 Cl6 La N8 -","- C720 H448 Cl48 La8 N64 -","8","0.25","","Yamashita, Ken-Ichi; Sakata, Naoya; Ogawa, Takuji","Systematic Structural Elucidation for the Protonated Form of Rare Earth Bis(porphyrinato) Double-Decker Complexes: Direct Structural Evidence of the Location of the Attached Proton.","Inorganic chemistry","2016","55","17","8935","8942","10.1021/acs.inorgchem.6b01442","","","0.71073","MoKα","","0.0663","0.0613","","","0.1693","0.173","","","","","","1.153","","","","has coordinates,has disorder","233203","2020-10-21","18:00:00",""
"4348631","21.031","0.004","21.522","0.004","31.236","0.006","90","","90","","90","","14138","5","193","2","193","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C90 H61 Cl4 N8 Tb -","- C90 H60 Cl4 N8 Tb -","- C720 H480 Cl32 N64 Tb8 -","8","0.25","","Yamashita, Ken-Ichi; Sakata, Naoya; Ogawa, Takuji","Systematic Structural Elucidation for the Protonated Form of Rare Earth Bis(porphyrinato) Double-Decker Complexes: Direct Structural Evidence of the Location of the Attached Proton.","Inorganic chemistry","2016","55","17","8935","8942","10.1021/acs.inorgchem.6b01442","","","0.71073","MoKα","","0.0898","0.0887","","","0.2183","0.2188","","","","","","1.365","","","","has coordinates","233203","2020-10-21","18:00:00",""
"4348632","21.762","0.004","22.083","0.004","30.28","0.006","90","","90","","90","","14552","5","123","2","123","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C95 H73 N8 O2 Tb -","- C88 H56 N8 Tb -","- C704 H448 N64 Tb8 -","8","0.25","","Yamashita, Ken-Ichi; Sakata, Naoya; Ogawa, Takuji","Systematic Structural Elucidation for the Protonated Form of Rare Earth Bis(porphyrinato) Double-Decker Complexes: Direct Structural Evidence of the Location of the Attached Proton.","Inorganic chemistry","2016","55","17","8935","8942","10.1021/acs.inorgchem.6b01442","","","0.71073","MoKα","","0.07","0.0456","","","0.0936","0.1014","","","","","","0.985","","","","has coordinates","233203","2020-10-21","18:00:00",""
"4348633","21.889","0.004","21.89","0.004","30.55","0.006","90","","90","","90","","14638","5","123","2","123","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C100 H68 N8 Tb -","- C100 H68 N8 Tb -","- C800 H544 N64 Tb8 -","8","0.25","","Yamashita, Ken-Ichi; Sakata, Naoya; Ogawa, Takuji","Systematic Structural Elucidation for the Protonated Form of Rare Earth Bis(porphyrinato) Double-Decker Complexes: Direct Structural Evidence of the Location of the Attached Proton.","Inorganic chemistry","2016","55","17","8935","8942","10.1021/acs.inorgchem.6b01442","","","0.71073","MoKα","","0.083","0.0617","","","0.1134","0.1206","","","","","","1.184","","","","has coordinates,has disorder","233203","2020-10-21","18:00:00",""
"4348634","21.495","0.004","21.68","0.004","31.325","0.006","90","","90","","90","","14598","5","123","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C90 H61 Cl2 N8 Tb -","- C90 H60 Cl2 N8 Tb -","- C720 H480 Cl16 N64 Tb8 -","8","0.25","","Yamashita, Ken-Ichi; Sakata, Naoya; Ogawa, Takuji","Systematic Structural Elucidation for the Protonated Form of Rare Earth Bis(porphyrinato) Double-Decker Complexes: Direct Structural Evidence of the Location of the Attached Proton.","Inorganic chemistry","2016","55","17","8935","8942","10.1021/acs.inorgchem.6b01442","","","0.71073","MoKα","","0.0819","0.0709","","","0.1694","0.1758","","","","","","1.205","","","","has coordinates","233203","2020-10-21","18:00:00",""
"4349480","22.503","0.005","28.973","0.006","29.063","0.006","90","","90","","90","","18948","7","173","2","173","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C27 H17 Eu O7 -","- C27 H17 Eu O7 -","- C864 H544 Eu32 O224 -","32","1","","Liu, Cai-Ming; Zhang, De-Qing; Zhao, Yong-Sheng; Hao, Xiang; Zhu, Dao-Ben","Two-step warming solvothermal syntheses, luminescence and slow magnetic relaxation of isostructural dense LnMOFs based on nanoscale 3-connected linkers","Inorganic Chemistry Frontiers","2016","3","8","1076","","10.1039/C6QI00137H","","","0.71073","MoKα","","0.0867","0.0851","","","0.1812","0.1822","","","","","","1.189","","","","has coordinates","234809","2020-10-21","18:00:00",""
"4349481","22.497","0.005","28.847","0.006","28.988","0.006","90","","90","","90","","18812","7","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H17 Dy N0 O7 -","- C27 H17 Dy O7 -","- C864 H544 Dy32 O224 -","32","1","","Liu, Cai-Ming; Zhang, De-Qing; Zhao, Yong-Sheng; Hao, Xiang; Zhu, Dao-Ben","Two-step warming solvothermal syntheses, luminescence and slow magnetic relaxation of isostructural dense LnMOFs based on nanoscale 3-connected linkers","Inorganic Chemistry Frontiers","2016","3","8","1076","","10.1039/C6QI00137H","","","0.71073","MoKα","","0.0938","0.0919","","","0.2165","0.2168","","","","","","1.123","","","","has coordinates","234809","2020-10-21","18:00:00",""
"4349518","11.337","0.004","19.412","0.007","33.776","0.011","90","","90","","90","","7433","4","293.15","","293","2","","","","","","","none","7","F d d d :2","-F 2uv 2vw","70","C1","C1","","- C30 H36 Br2 Cl2 N6 O12 Zn -","- C30 H36 Br2 Cl2 N6 O12 Zn -","- C240 H288 Br16 Cl16 N48 O96 Zn8 -","8","0.25","","Li, Hong-Qing; Ding, Zhong-Yu; Pan, Yao; Liu, Chun-Hua; Zhu, Yuan-Yuan","Fluorescence tuning of Zn(ii)-based metallo-supramolecular coordination polymers and their application for picric acid detection","Inorganic Chemistry Frontiers","2016","3","11","1363","","10.1039/C6QI00267F","","","0.71075","MoKα","","0.0747","0.061","","","0.1322","0.1394","","","","","","1.216","","","","has coordinates,has disorder","234847","2020-10-21","18:00:00",""
"4350130","22.6394","0.0018","28.2017","0.0018","45.26","0.004","90","","90","","90","","28897","4","100","2","100","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C53 H46 Cl9 Co Cu2 N17 O16 P6 -","- C49.7778 H35.5556 Cl8.88889 Co0.888889 Cu1.77778 N15.1111 O15.1111 P5.33333 -","- C896 H640 Cl160 Co16 Cu32 N272 O272 P96 -","18","0.5625","","Chandrasekhar, Vadapalli; Pandian, Balasubramanian Murugesa; Azhakar, Ramachandran","Di- and trinuclear complexes derived from hexakis(2-pyridyloxy)cyclotriphosphazene. Unusual P-O bond cleavage in the formation of [{(L'CuCl)2(Co(NO3)}Cl] (L' = N3P3(OC5H4N)5(O)).","Inorganic chemistry","2006","45","9","3510","3518","10.1021/ic0517467","","","0.71073","MoKα","","0.0755","0.0598","","","0.166","0.1787","","","","","","1.027","","","","has coordinates,has disorder","239752","2020-10-21","18:00:00",""
"4350190","19.008","0.003","24.794","0.004","34.955","0.006","90","","90","","90","","16474","5","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C47 H31 Ag B F4 N4 O -","- C47 H31 Ag B F4 N4 O -","- C752 H496 Ag16 B16 F64 N64 O16 -","16","0.5","","Dong, Yu-Bin; Xu, Hong-Xia; Ma, Jian-Ping; Huang, Ru-Qi","Silver(I) coordination polymers based on a nano-sized bent bis(3-acetylenylphenyl-(4-cyanophenyl))oxadiazole ligand: the role of ligand isomerism and the templating effect of polyatomic anions and solvent intermediates.","Inorganic chemistry","2006","45","8","3325","3343","10.1021/ic052158w","","","0.71073","MoKα","","0.1137","0.0593","","","0.1355","0.1524","","","","","","0.952","","","","has coordinates","239771","2020-10-21","18:00:00",""
"4350562","21.5219","0.0003","28.3611","0.0005","33.4189","0.0006","90","","90","","90","","20398.4","0.6","150","1","150","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C97 H90 Cl18 N16 Ni4 O8 -","- C97 H90 Cl18 N16 Ni4 O8 -","- C776 H720 Cl144 N128 Ni32 O64 -","8","0.25","","López, Xavier; Huang, Ming-Yi; Huang, Gin-Chen; Peng, Shie-Ming; Li, Feng-Yin; Bénard, Marc; Rohmer, Marie-Madeleine","Even-numbered metal chain complexes: synthesis, characterization, and DFT analysis of [Ni4(mu4-Tsdpda)4(H2O)2] (Tsdpda2- = N-(p-toluenesulfonyl)dipyridyldiamido), [Ni4(mu4-Tsdpda)4]+, and related Ni4 string complexes.","Inorganic chemistry","2006","45","22","9075","9084","10.1021/ic0612505","","","0.71073","MoKα","","0.0828","0.0555","","","0.1583","0.1771","","","","","","1.084","","","","has coordinates","239944","2020-10-21","18:00:00",""
"4500385","18.3308","0.0011","22.5675","0.001","31.7435","0.0013","90","","90","","90","","13131.7","1.1","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C23 H14 Co0.5 N5 O7.5 S -","- C23 H14 Co0.5 N5 O7.5 S -","- C368 H224 Co8 N80 O120 S16 -","16","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","1.54178","CuKα","","0.0907","0.0829","","","0.2143","0.2188","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500688","13.6","0.003","15.107","0.003","33","0.007","90","","90","","90","","6780","2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C28 H46 Ag2 N4 O13 -","- C28 H46 Ag2 N4 O13 -","- C224 H368 Ag16 N32 O104 -","8","0.25","","Luo, Geng-Geng; Xiong, Hong-Bo; Sun, Di; Wu, Dong-Liang; Huang, Rong-Bin; Dai, Jing-Cao","A Discrete Spirocyclic (H2O)9Cluster and 1D Novel Water Chain with Tetrameric and Octameric Clusters in Cationic Hosts","Crystal Growth & Design","2011","11","5","1948","","10.1021/cg200111j","","","0.71073","MoKα","","0.0221","0.0207","","","0.0532","0.054","","","","","","1.066","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500755","25.5852","0.0015","29.62","0.0018","58.413","0.004","90","","90","","90","","44267","5","293","2","293","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C20 H16 Cl Cu3 Mo N4 O S3 -","- C20 H16 Cl Cu3 Mo N4 O S3 -","- C640 H512 Cl32 Cu96 Mo32 N128 O32 S96 -","32","1","","Han, Yi; Zhang, Zhenhua; Liu, Yanyan; Niu, Yunyin; Ding, Degang; Wu, Benlai; Hou, Hongwei; Fan, Yaoting","External Template-Assisted Self-Assembly:Design and Synthesis of 4,4′-bipy-Based Mo(W)/Cu/S Heterothiometallic Polymeric Clusters Directed by 1,1′-Bis(pyridinium)methylene Cation","Crystal Growth & Design","2011","11","8","3448","","10.1021/cg200250m","","","0.71073","MoKα","","0.1116","0.053","","","0.1492","0.1572","","","","","","1.016","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500756","25.569","0.004","29.638","0.004","58.594","0.009","90","","90","","90","","44403","11","296","2","296","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C20 H16 Cl Cu3 N4 O S3 W -","- C20 H16 Cl Cu3 N4 O S3 W -","- C640 H512 Cl32 Cu96 N128 O32 S96 W32 -","32","1","","Han, Yi; Zhang, Zhenhua; Liu, Yanyan; Niu, Yunyin; Ding, Degang; Wu, Benlai; Hou, Hongwei; Fan, Yaoting","External Template-Assisted Self-Assembly:Design and Synthesis of 4,4′-bipy-Based Mo(W)/Cu/S Heterothiometallic Polymeric Clusters Directed by 1,1′-Bis(pyridinium)methylene Cation","Crystal Growth & Design","2011","11","8","3448","","10.1021/cg200250m","","","0.71073","MoKα","","0.0945","0.0526","","","0.1172","0.1253","","","","","","1.011","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4501310","51.844","0.011","8.1994","0.0019","24.616","0.006","90","","90","","90","","10464","4","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C22 H24 Cl2 N4 O10 -","- C22 H24 Cl2 N4 O10 -","- C352 H384 Cl32 N64 O160 -","16","0.5","","Kalita, Dipjyoti; Baruah, Jubaraj B.","Acid Inclusion Properties of Helical Self-Assembly of a 5,5′-Biquinoline Derivative","Crystal Growth & Design","2011","11","11","5131","","10.1021/cg201052k","","","0.71073","MoKα","","0.2256","0.1216","","","0.26","0.2872","","","","","","1.972","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501730","16.847","0.002","20.71","0.004","22.468","0.003","90","","90","","90","","7839","2","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C40 H23 N12 Nd3 O18 -","- C40 N12 Nd3 O18 -","- C320 N96 Nd24 O144 -","8","0.25","","Jing, Xuemin; Meng, He; Li, Guanghua; Yu, Yang; Huo, Qisheng; Eddaoudi, Mohamed; Liu, Yunling","Construction of Three Metal−Organic Frameworks Based on Multifunctional T-Shaped Tripodal Ligands, H3PyImDC","Crystal Growth & Design","2010","10","8","3489","","10.1021/cg1003403","","","0.71073","MoKα","","0.0463","0.0342","","","0.0815","0.0911","","","","","","1.157","","","","has coordinates","179548","2020-10-21","18:00:00",""
"4501748","10.7448","0.0017","36.868","0.006","60.435","0.01","90","","90","","90","","23941","7","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H18 N O4 Zn -","- C27 H18 N O4 Zn -","- C864 H576 N32 O128 Zn32 -","32","1","","Song, Xiaokai; Liu, Xinfang; Oh, Minhak; Lah, Myoung Soo","A Microporous Metal−Organic Framework Based on [2 + 2] Parallel and Inclined Interpenetrated 2D Sheets Interconnected by an Auxiliary Linker","Crystal Growth & Design","2010","10","7","3222","","10.1021/cg100357q","","","0.71073","MoKα","","0.1257","0.0774","","","0.1897","0.2103","","","","","","0.958","","","","has coordinates,has disorder","179548","2020-10-21","18:00:00",""
"4502479","10.7082","0.0004","32.3079","0.0009","58.66","0.002","90","","90","","90","","20294","1.2","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H21 N12 O6 Ru -","- C27 H21 N12 O6 Ru -","- C432 H336 N192 O96 Ru16 -","16","0.5","","Yang, Li-Fei; Cao, Man-Li; Cui, Ying; Wu, Jin-Ji; Ye, Bao-Hui","Liquid-Assisted Solid-State Reaction: Formation of a Three-Dimensional Hydrogen-Bonded Network and Evidence for Proton Induced Electron Transfer","Crystal Growth & Design","2010","10","3","1263","","10.1021/cg901286b","","","0.71073","MoKα","","0.0784","0.0504","","","0.1171","0.1238","","","","","","1.006","","","","has coordinates","179555","2020-10-21","18:00:00",""
"4502558","17.2369","0.0008","35.5472","0.0019","9.9845","0.0005","90","","90","","90","","6117.7","0.5","296","2","296","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C24 H36 Cu2 F6 N4 Nb O8 -","- C24 H36 Cu2 F6 N4 Nb O8 -","- C192 H288 Cu16 F48 N32 Nb8 O64 -","8","0.25","","Lin, Haisheng; Maggard, Paul A.","Microporosity, Optical Bandgap Sizes, and Photocatalytic Activity of M(I)-Nb(V) (M = Cu, Ag) Oxyfluoride Hybrids","Crystal Growth & Design","2010","10","3","1323","","10.1021/cg9013625","","","0.71073","MoKα","","0.0641","0.044","","","0.085","0.0895","","","","","","1.032","","","","has coordinates","179556","2020-10-21","18:00:00",""
"4502751","22.128","0.013","28.524","0.016","29.033","0.018","90","","90","","90","","18325","19","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 N3 O7 Y -","- C24 H12 N3 O7 Y -","- C768 H384 N96 O224 Y32 -","32","1","","Zhang, Huabin; Li, Ning; Tian, Chongbin; Liu, Tianfu; Du, Fenglei; Lin, Ping; Li, Zhihua; Du, Shaowu","Unusual High Thermal Stability within a Series of Novel Lanthanide TATB Frameworks: Synthesis, Structure, and Properties (TATB = 4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoate)","Crystal Growth & Design","2012","12","2","670","","10.1021/cg2008655","","","0.71073","MoKα","","0.1045","0.087","","","0.2005","0.2113","","","","","","1.033","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4502752","22.252","0.004","28.629","0.005","29.191","0.005","90","","90","","90","","18596","6","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 Eu N3 O7 -","- C24 H12 Eu N3 O7 -","- C768 H384 Eu32 N96 O224 -","32","1","","Zhang, Huabin; Li, Ning; Tian, Chongbin; Liu, Tianfu; Du, Fenglei; Lin, Ping; Li, Zhihua; Du, Shaowu","Unusual High Thermal Stability within a Series of Novel Lanthanide TATB Frameworks: Synthesis, Structure, and Properties (TATB = 4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoate)","Crystal Growth & Design","2012","12","2","670","","10.1021/cg2008655","","","0.71073","MoKα","","0.0415","0.0411","","","0.1242","0.1245","","","","","","1.049","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4502753","22.245","0.006","28.583","0.007","29.143","0.012","90","","90","","90","","18530","10","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 Gd N3 O7 -","- C24 H12 Gd N3 O7 -","- C768 H384 Gd32 N96 O224 -","32","1","","Zhang, Huabin; Li, Ning; Tian, Chongbin; Liu, Tianfu; Du, Fenglei; Lin, Ping; Li, Zhihua; Du, Shaowu","Unusual High Thermal Stability within a Series of Novel Lanthanide TATB Frameworks: Synthesis, Structure, and Properties (TATB = 4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoate)","Crystal Growth & Design","2012","12","2","670","","10.1021/cg2008655","","","0.71073","MoKα","","0.0497","0.0476","","","0.1325","0.1343","","","","","","1.031","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4502754","28.614","0.0012","22.2004","0.0007","29.1229","0.0014","90","","90","","90","","18500.1","1.3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 N3 O7 Tb -","- C24 H12 N3 O7 Tb -","- C768 H384 N96 O224 Tb32 -","32","1","","Zhang, Huabin; Li, Ning; Tian, Chongbin; Liu, Tianfu; Du, Fenglei; Lin, Ping; Li, Zhihua; Du, Shaowu","Unusual High Thermal Stability within a Series of Novel Lanthanide TATB Frameworks: Synthesis, Structure, and Properties (TATB = 4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoate)","Crystal Growth & Design","2012","12","2","670","","10.1021/cg2008655","","","0.71073","MoKα","","0.0367","0.035","","","0.1051","0.1065","","","","","","1.024","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4502755","22.262","0.009","28.637","0.011","29.118","0.011","90","","90","","90","","18563","13","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 Dy N3 O7 -","- C24 H12 Dy N3 O7 -","- C768 H384 Dy32 N96 O224 -","32","1","","Zhang, Huabin; Li, Ning; Tian, Chongbin; Liu, Tianfu; Du, Fenglei; Lin, Ping; Li, Zhihua; Du, Shaowu","Unusual High Thermal Stability within a Series of Novel Lanthanide TATB Frameworks: Synthesis, Structure, and Properties (TATB = 4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoate)","Crystal Growth & Design","2012","12","2","670","","10.1021/cg2008655","","","0.71073","MoKα","","0.0615","0.0569","","","0.1533","0.1568","","","","","","1.158","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4502756","22.154","0.009","28.577","0.011","29.053","0.012","90","","90","","90","","18393","13","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 Ho N3 O7 -","- C24 H12 Ho N3 O7 -","- C768 H384 Ho32 N96 O224 -","32","1","","Zhang, Huabin; Li, Ning; Tian, Chongbin; Liu, Tianfu; Du, Fenglei; Lin, Ping; Li, Zhihua; Du, Shaowu","Unusual High Thermal Stability within a Series of Novel Lanthanide TATB Frameworks: Synthesis, Structure, and Properties (TATB = 4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoate)","Crystal Growth & Design","2012","12","2","670","","10.1021/cg2008655","","","0.71073","MoKα","","0.0806","0.0703","","","0.1471","0.1524","","","","","","1.169","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4502757","22.1535","0.0011","28.595","0.003","29.043","0.003","90","","90","","90","","18398","3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 Er N3 O7 -","- C24 H12 Er N3 O7 -","- C768 H384 Er32 N96 O224 -","32","1","","Zhang, Huabin; Li, Ning; Tian, Chongbin; Liu, Tianfu; Du, Fenglei; Lin, Ping; Li, Zhihua; Du, Shaowu","Unusual High Thermal Stability within a Series of Novel Lanthanide TATB Frameworks: Synthesis, Structure, and Properties (TATB = 4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoate)","Crystal Growth & Design","2012","12","2","670","","10.1021/cg2008655","","","0.71073","MoKα","","0.0502","0.0494","","","0.1357","0.1361","","","","","","1.362","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4504160","13.14","0.003","18.138","0.005","25.328","0.007","90","","90","","90","","6037","3","133","2","133","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","4-Carboxyphenylboronic acid hydrate","","","- C7 H7.5 B O4.25 -","- C7 H7.5 B O4.25 -","- C224 H240 B32 O136 -","32","1","","SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Solid-State Structures of 4-Carboxyphenylboronic Acid and Its Hydrates","Crystal Growth & Design","2007","7","5","944","","10.1021/cg060860c","","","0.71073","MoKα","","0.081","0.0523","","","0.1335","0.1414","","","","","","1.058","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505422","22.824","0.003","25.799","0.003","36.354","0.005","90","","90","","90","","21407","5","90","1","90","1","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C65 H58 N4 O9 -","- C65 H48 N4 O9 -","- C1040 H768 N64 O144 -","16","0.5","","Ma, Bao-Qing; Coppens, Philip","Variable Conformation of Benzophenone in a Series of Resorcinarene-Based Supramolecular Frameworks","Crystal Growth & Design","2004","4","6","1377","","10.1021/cg0499562","","","0.71073","MoKα","","0.1709","0.0863","","","0.2177","0.2559","","","","","","0.982","","","","has coordinates,has disorder","179589","2020-10-21","18:00:00",""
"4505781","7.4584","0.0002","10.811","0.0005","31.7206","0.0013","90","","90","","90","","2557.72","0.17","123","2","123","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C6 H12 Cl4 Hg2 N4 -","- C6 H12 Cl4 Hg2 N4 -","- C48 H96 Cl32 Hg16 N32 -","8","0.25","","Batten, Stuart R.; Harris, Alexander R.; Murray, Keith S.; Smith, Jonathan P.","Crystal Engineering with Mercuric Chloride","Crystal Growth & Design","2002","2","2","87","","10.1021/cg0155696","","","0.71073","MoKα","","0.033","0.029","","","0.0768","0.0775","","","","","","1.136","","","","has coordinates","179593","2020-10-21","18:00:00",""
"4506175","12.58","0.002","24.563","0.005","33.566","0.007","90","","90","","90","","10372","3","298","2","298","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C21 H16 Ag2 N4 O2 -","- C21 H16 Ag2 N4 O2 -","- C336 H256 Ag32 N64 O32 -","16","0.5","","Sun, Di; Yan, Zhi-Hao; Liu, Meijiao; Xie, Hanyi; Yuan, Shuai; Lu, Haifeng; Feng, Shengyu; Sun, Daofeng","Three- and Eight-Fold Interpenetrated ThSi2Metal‒Organic Frameworks Fine-Tuned by the Length of Ligand","Crystal Growth & Design","2012","12","6","2902","","10.1021/cg300085f","","","0.71073","","","0.0631","0.0566","","","0.1545","0.1638","","","","","","1.093","","","","has coordinates","179597","2020-10-21","18:00:00",""
"4506393","17.216","0.0006","28.9876","0.0012","30.7307","0.0011","90","","90","","90","","15336.2","1","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C64 H44 N8 O12 Zn2 -","- C64 H44 N8 O12 Zn2 -","- C512 H352 N64 O96 Zn16 -","8","0.25","","Luo, Feng; Yuan, Zi-Zun; Feng, Xue-Feng; Batten, Stuart R.; Li, Jian-Qiang; Luo, Ming-Biao; Liu, Shu-Juan; Xu, Wen-Yuan; Sun, Gong-Ming; Song, Yu-Mei; Huang, Hai-Xiao; Tian, Xian-Zhao","Multifunctional 3-Fold Interpenetrated Porous Metal‒Organic Frameworks Composed of Unprecedented Self-Catenated Networks","Crystal Growth & Design","2012","12","7","3392","","10.1021/cg300585t","","","0.71073","MoKα","","0.0836","0.0534","","","0.1336","0.1445","","","","","","0.946","","","","has coordinates","179599","2020-10-21","18:00:00",""
"4508957","26.7127","0.0008","17.9748","0.0007","17.8024","0.0007","90","","90","","90","","8547.9","0.5","150","2","150","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C64 H60 Eu4 N12 O34 -","- C64 H56 Eu4 N12 O34 -","- C256 H224 Eu16 N48 O136 -","4","0.125","","Shi, Fa-Nian; Cunha-Silva, Luís; Trindade, Tito; Paz, Filipe A. Almeida; Rocha, João","Three-Dimensional Lanthanide−Organic Frameworks Based on Di-, Tetra-, and Hexameric Clusters","Crystal Growth & Design","2009","9","5","2098","","10.1021/cg8004932","","","0.71073","MoKα","","0.037","0.0267","","","0.0746","0.0799","","","","","","1.111","","","","has coordinates","179625","2020-10-21","18:00:00",""
"4508958","26.4473","0.0016","17.9442","0.001","17.3804","0.0011","90","","90","","90","","8248.3","0.9","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C64 H60 Er4 N12 O34 -","- C64 H56 Er4 N12 O34 -","- C256 H224 Er16 N48 O136 -","4","0.125","","Shi, Fa-Nian; Cunha-Silva, Luís; Trindade, Tito; Paz, Filipe A. Almeida; Rocha, João","Three-Dimensional Lanthanide−Organic Frameworks Based on Di-, Tetra-, and Hexameric Clusters","Crystal Growth & Design","2009","9","5","2098","","10.1021/cg8004932","","","0.71073","MoKα","","0.0275","0.0235","","","0.0629","0.0648","","","","","","1.112","","","","has coordinates","179625","2020-10-21","18:00:00",""
"4509384","13.5179","0.0009","25.9084","0.0017","30.351","0.002","90","","90","","90","","10629.7","1.2","298","2","298","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C200 H200 Cl8 Co4 N40 O40 -","- C200 H192 Cl8 Co4 N40 O40 -","- C400 H384 Cl16 Co8 N80 O80 -","2","0.0625","","Chen, Jian-Qiao; Cai, Yue-Peng; Fang, Hua-Cai; Zhou, Zheng-Yuan; Zhan, Xu-Lin; Zhao, Gang; Zhang, Zhong","Construction of Three-Dimensional Metal−Organic Frameworks with Helical Character through Coordinative and Supramolecular Interactions","Crystal Growth & Design","2009","9","3","1605","","10.1021/cg8013317","","","0.71073","MoKα","","0.1055","0.0797","","","0.2086","0.2261","","","","","","1.048","","","","has coordinates","179629","2020-10-21","18:00:00",""
"4510682","17.5187","0.0006","26.0111","0.0005","39.6741","0.0011","90","","90","","90","","18078.7","0.9","122","4","122","4","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C16 H8 Cu N2 Na2 O12.88 S -","- C16 H8 Cu N2 Na2.0155 O12.806 S -","- C512 H256 Cu32 N64 Na64.496 O409.792 S32 -","32","1","","Allão Cassaro, Rafael A.; Ciattini, Samuele; Soriano, Stephane; Amorim, Hélio S.; Speziali, Nivaldo L.; Andruh, Marius; Vaz, Maria G. F.","An Angular Bis-Oxamate Tecton for the Construction of Heterobimetallic Coordination Polymers","Crystal Growth & Design","2013","13","7","2711","","10.1021/cg400547a","","","0.71073","MoKα","","0.1077","0.0843","","","0.2253","0.2498","","","","","","1.06","","","","has coordinates,has disorder","179653","2020-10-21","18:00:00",""
"4511398","33.1272","0.0012","65.1158","0.001","19.1804","0.0003","90","","90","","90","","41374.1","1.8","100","0.11","100","0.11","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H8 O16 S4 Zn3 -","- C24 O16 S4 Zn3 -","- C768 O512 S128 Zn96 -","32","1","","He, Yan-Ping; Tan, Yan-Xi; Zhang, Jian","Organic Cation Templated Synthesis of Three Zinc‒2,5-Thiophenedicarboxylate Frameworks for Selective Gas Sorption","Crystal Growth & Design","2014","14","7","3493","","10.1021/cg500436g","","","0.71073","MoKα","","0.1258","0.1166","","","0.2954","0.3022","","","","","","1.042","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4513543","12.7731","0.0013","29.872","0.003","33.792","0.004","90","","90","","90","","12894","2","200","2","200","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C29 H12 Ag F3 N4 O3.45 S7 -","- C29 H12 Ag F3 N4 O3.47 S7 -","- C464 H192 Ag16 F48 N64 O55.52 S112 -","16","0.5","","Andreychuk, Nicholas R.; Allard, Sheena R.; Parent, Shawna L. M.; Assoud, Abdeljalil; MacKinnon, Craig D.","Not Too Big and Not Too Small: “Goldilocks” Anion Size for Three-Dimensional Metal‒Organic Frameworks Containing Oligothiophene Dinitrile Ligands (C4H2S)n(CN)2(n= 1, 2, 3) Bridging Silver(I) Cations","Crystal Growth & Design","2015","15","9","4377","","10.1021/acs.cgd.5b00698","","","0.71073","MoKα","","0.0816","0.0674","","","0.1452","0.1489","","","","","","1.475","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"4515242","21.901","0.014","24.944","0.016","29.952","0.018","90","","90","","90","","16363","18","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C42 H50 Cu N2 O2 -","- C42 H50 Cu N2 O2 -","- C672 H800 Cu16 N32 O32 -","16","0.5","","Jangir, Ritambhara; Ansari, Mursaleem; Kaleeswaran, Dhananjayan; Rajaraman, Gopalan; Palaniandavar, Mallayan; Murugavel, Ramaswamy","Unprecedented Copper(II) Complex with a Topoquinone-like Moiety as a Structural and Functional Mimic for Copper Amine Oxidase: Role of Copper(II) in the Genesis and Amine Oxidase Activity","ACS Catalysis","2019","","","10940","","10.1021/acscatal.9b02326","","","1.54187","CuKα","","0.1441","0.1263","","","0.3451","0.3622","","","","","","1.139","","","","has coordinates","223243","2020-10-21","18:00:00",""
"4516164","17.8353","0.0008","25.3177","0.0013","27.4906","0.0011","90","","90","","90","","12413.3","1","120","2","120","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Bis-[2,4,6-tri(pyrazol-1-yl)pyrimidine]iron(II) di(tetrafluoroborate)","","- C26 H20 B2 F8 Fe N16 -","- C26 H20 B2 F8 Fe N16 -","- C416 H320 B32 F128 Fe16 N256 -","16","0.5","","Berdiell, Izar Capel; Kulak, Alexander N.; Warriner, Stuart L.; Halcrow, Malcolm A.","Heterometallic Coordination Polymer Gels Supported by 2,4,6-Tris(pyrazol-1-yl)-1,3,5-triazine.","ACS omega","2018","3","12","18466","18474","10.1021/acsomega.8b02508","","","1.54184","CuKα","","0.0851","0.0755","","","0.2077","0.2157","","","","","","1.091","","","","has coordinates,has disorder","226157","2020-10-21","18:00:00",""
"4518148","8.9164","0.0003","49.9492","0.0016","25.1934","0.0009","90","","90","","90","","11220.3","0.7","220","0.1","220","0.1","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C42 H28 Br2 F12 N6 Os P2 -","- C42 H28 Br2 F12 N6 Os P2 -","- C336 H224 Br16 F96 N48 Os8 P16 -","8","0.25","","Ravetz, Benjamin D.; Tay, Nicholas E. S.; Joe, Candice L.; Sezen-Edmonds, Melda; Schmidt, Michael A.; Tan, Yichen; Janey, Jacob M.; Eastgate, Martin D.; Rovis, Tomislav","Development of a Platform for Near-Infrared Photoredox Catalysis","ACS Central Science","2020","","","","","10.1021/acscentsci.0c00948","","x-ray","0.71073","MoKα","","0.0664","0.0552","","","0.1087","0.1119","","","","","","1.296","","","","has coordinates,has disorder","258495","2020-10-21","18:00:00",""
"4518592","13.359","0.003","49.113","0.012","51.861","0.012","90","","90","","90","","34026","14","183","2","183","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C46 H37 N0 O8 -","- C46 H37 O8 -","- C736 H592 O128 -","16","0.5","","Wang, Jia-Xin; Gu, Xiao-Wen; Lin, Yu-Xin; Li, Bin; Qian, Guodong","A Novel Hydrogen-Bonded Organic Framework with Highly Permanent Porosity for Boosting Ethane/Ethylene Separation","ACS Materials Letters","2021","","","497","503","10.1021/acsmaterialslett.1c00013","","","1.54178","CuKα","","0.1047","0.082","","","0.2056","0.2215","","","","","","1.125","","","","has coordinates","263456","2021-03-30","21:49:03",""
"7000378","29.244","0.006","36.649","0.007","38.215","0.008","90","","90","","90","","40957","14","90","2","90","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C28 H111 Hf3 N7 O82 P2 W18 -","- C16 Hf3 N4 O79 P2 W18 -","- C256 Hf48 N64 O1264 P32 W288 -","16","0.5","","Saku, Yoshio; Sakai, Yoshitaka; Shinohara, Akira; Hayashi, Kunihiko; Yoshida, Shoko; Kato, Chika N.; Yoza, Kenji; Nomiya, Kenji","Sandwich-type HfIV and ZrIVcomplexes composed of tri-lacunary Keggin polyoxometalates: structure of [M3(μ-OH)3(A-α-PW9O34)2]9− (M = Hf and Zr)","Dalton Transactions","2009","","5","805","813","10.1039/b813710m","","","0.71073","MoKα","","0.0431","0.0348","","","0.0967","0.1064","","","","","","1.087","","","","has coordinates","209569","2020-10-21","18:00:00",""
"7000379","29.237","0.002","36.741","0.003","38.239","0.003","90","","90","","90","","41076","5","90","2","90","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C28 H113 N7 O83 P2 W18 Zr3 -","- C21 N7 O81 P2 W18 Zr3 -","- C336 N112 O1296 P32 W288 Zr48 -","16","0.5","","Saku, Yoshio; Sakai, Yoshitaka; Shinohara, Akira; Hayashi, Kunihiko; Yoshida, Shoko; Kato, Chika N.; Yoza, Kenji; Nomiya, Kenji","Sandwich-type HfIV and ZrIVcomplexes composed of tri-lacunary Keggin polyoxometalates: structure of [M3(μ-OH)3(A-α-PW9O34)2]9− (M = Hf and Zr)","Dalton Transactions","2009","","5","805","813","10.1039/b813710m","","","0.71073","MoKα","","0.043","0.0314","","","0.0856","0.0984","","","","","","1.109","","","","has coordinates","209569","2020-10-21","18:00:00",""
"7002635","11.4361","0.0006","26.9523","0.0008","47.507","0.003","90","","90","","90","","14643","1.3","150","2","150","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C62 H68 N20 O28 Pt4 -","- C62 H52 N20 O28 Pt4 -","- C496 H416 N160 O224 Pt32 -","8","0.25","","Das, Neeladri; Sanz Miguel, Pablo J.; Khutia, Anupam; Lazar, Martina; Lippert, Bernhard","Hybrids between classical and metallacalix[4]arenes based on uracil and cis-PtIIL2 entities (L = P(Ph)3 or L2 = 2,2′-bipyridine)","Dalton Transactions","2009","","42","9120","","10.1039/b916178n","","","0.71073","MoKα","","0.127","0.0807","","","0.1764","0.1895","","","","","","1.07","","","","has coordinates","179730","2020-10-21","18:00:00",""
"7003150","13.113","0.003","28.739","0.006","39.885","0.008","90","","90","","90","","15031","6","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C32 H54 As8 N12 O41 V12 Zn4 -","- C32 H32 As8 N12 O41 V12 Zn4 -","- C256 H256 As64 N96 O328 V96 Zn32 -","8","0.25","","Qi, Yanfei; Li, Yangguang; Wang, Enbo; Zhang, Zhiming; Chang, Song","Metal-controlled self-assembly of arsenic‒vanadium-cluster backbones with organic ligands","Dalton Transactions","2008","","17","2335","2345","10.1039/b713115a","","","0.71073","MoKα","","0.1061","0.0694","","","0.1781","0.2007","","","","","","1.063","","","","has coordinates,has disorder","179735","2020-10-21","18:00:00",""
"7003263","15.0923","0.0014","19.202","0.0014","35.566","0.003","90","","90","","90","","10307.1","1.5","193","2","193","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C52 H40 F20 N4 O4 Pd -","- C52 H40 F20 N4 O4 Pd -","- C416 H320 F160 N32 O32 Pd8 -","8","0.25","","Khusniyarov, Marat M.; Harms, Klaus; Burghaus, Olaf; Sundermeyer, Jörg; Sarkar, Biprajit; Kaim, Wolfgang; van Slageren, Joris; Duboc, Carole; Fiedler, Jan","A series of metal complexes with the non-innocent N,N′-bis(pentafluorophenyl)-o-phenylenediamido ligand: twisted geometry for tuning the electronic structure","Dalton Transactions","2008","","10","1355","1365","10.1039/b714974c","","","0.71073","MoKα","","0.0689","0.0458","","","0.0987","0.1064","","","","","","0.99","","","","has coordinates,has disorder","179736","2020-10-21","18:00:00",""
"7003978","13.96","0.003","22.82","0.005","24.218","0.005","90","","90","","90","","7715","3","173","2","173","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C54 H42 Li2 N2 -","- C54 H42 Li2 N2 -","- C432 H336 Li16 N16 -","8","0.25","","Dureen, Meghan A.; Stephan, Douglas W.","Biphenylamide ligand complexes of Li and Al: hemilabile arene donors?","Dalton Transactions","2008","","35","4723","4731","10.1039/b801772g","","","0.71073","MoKα","","0.0447","0.0339","","","0.0802","0.0863","","","","","","1.033","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7004111","11.3058","0.0018","17.284","0.003","37.082","0.006","90","","90","","90","","7246","2","113","2","113","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C36 H20 Co N6 O12 -","- C36 H20 Co N6 O12 -","- C288 H160 Co8 N48 O96 -","8","0.25","","Lin, Zhuojia; Li, Yang; Slawin, Alexandra M. Z.; Morris, Russell E.","Hydrogen-bond-directing effect in the ionothermal synthesis of metal coordination polymers","Dalton Transactions","2008","","30","3989","3994","10.1039/b802892c","","","0.71073","MoKα","","0.117","0.1065","","","0.2777","0.2873","","","","","","1.067","","","","has coordinates","179745","2020-10-21","18:00:00",""
"7005588","17.4718","0.0013","22.0788","0.0016","51.605","0.004","90","","90","","90","","19907","3","123","2","123","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C92 H92 Cl4 Cu2 Fe4 N16 O30 -","- C92 H90 Cl4 Cu2 Fe4 N16 O30 -","- C736 H720 Cl32 Cu16 Fe32 N128 O240 -","8","0.25","","Wei, Kai-Ju; Ni, Jia; Xie, Yong-Shu; Liu, Yangzhong; Liu, Qing-Liang","Self-assembled hetero-bimetallic coordination cage and cation-clusters with micro(2)-Cl bridging using a flexible two-arm ferrocene amide linker.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3390","3397","10.1039/b703363j","","","0.71073","MoKα","","0.0733","0.0578","","","0.1525","0.1672","","","","","","1.092","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005589","18.45","0.02","22.31","0.02","54.77","0.07","90","","90","","90","","22544","4","298","2","298","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C88 H76 Cl4 Fe4 N16 Ni2 O22 -","- C88 H76 Cl4 Fe4 N16 Ni2 O22 -","- C704 H608 Cl32 Fe32 N128 Ni16 O176 -","8","0.25","","Wei, Kai-Ju; Ni, Jia; Xie, Yong-Shu; Liu, Yangzhong; Liu, Qing-Liang","Self-assembled hetero-bimetallic coordination cage and cation-clusters with micro(2)-Cl bridging using a flexible two-arm ferrocene amide linker.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3390","3397","10.1039/b703363j","","","0.71073","MoKα","","0.1783","0.1012","","","0.2504","0.3331","","","","","","1.089","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005590","17.9062","0.0008","21.4295","0.0009","53.006","0.002","90","","90","","90","","20339.5","1.5","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C46 H46 Cl2 Co Fe N8 O13 -","- C46 H46 Cl2 Co Fe2 N8 O13 -","- C736 H736 Cl32 Co16 Fe32 N128 O208 -","16","0.5","","Wei, Kai-Ju; Ni, Jia; Xie, Yong-Shu; Liu, Yangzhong; Liu, Qing-Liang","Self-assembled hetero-bimetallic coordination cage and cation-clusters with micro(2)-Cl bridging using a flexible two-arm ferrocene amide linker.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3390","3397","10.1039/b703363j","","","0.71073","MoKα","","0.0987","0.0869","","","0.2515","0.2649","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005904","7.7384","0.0002","38.169","0.0008","50.8067","0.001","90","","90","","90","","15006.6","0.6","273","2","273","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","Silver(i) Hexafluorosilicate 2:3 Complex with 4,4'- Bipyridazine, Trihydrate","Silver(I) Hexafluorosilicate 2:3 Complex with 4,4'-Bipyridazine, Trihydrate","","- C24 H24 Ag4 F12 N12 O3 Si2 -","- C24 H24 Ag4 F12 N12 O3 Si2 -","- C384 H384 Ag64 F192 N192 O48 Si32 -","16","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0557","0.0483","","","0.1318","0.1364","","","","","","1.044","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7006397","23.27","0.003","24.089","0.004","29.24","0.004","90","","90","","90","","16391","4","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Biphenyl-2,2'-dicarboxylato-bis(4,4'-bipyridyl)-zinc(II)","Biphenyl-2,2'-dicarboxylato-bis(4,4'-bipyridyl)-zinc(II)","","- C24 H16 N2 O4 Zn -","- C24 H16 N2 O4 Zn -","- C768 H512 N64 O128 Zn32 -","32","1","","Dietzel, Pascal D. C.; Blom, Richard; Fjellvåg, Helmer","Increased dimensionalities of zinc-diphenic acid coordination polymers by simultaneous or subsequent addition of neutral bridging ligands.","Dalton transactions (Cambridge, England : 2003)","2006","","4","586","593","10.1039/b509746k","","","0.71073","MoKα","","0.0404","0.0311","","","0.0821","0.0861","","","","","","1.039","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7007585","16.607","0.005","28.742","0.009","52.334","0.016","90","","90","","90","","24980","13","150","2","150","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C31 H27 Ag B F4 N7 O2 -","- C31 H27 Ag B F4 N7 O2 -","- C992 H864 Ag32 B32 F128 N224 O64 -","32","1","","Argent, Stephen P.; Adams, Harry; Riis-Johannessen, Thomas; Jeffery, John C.; Harding, Lindsay P.; Clegg, William; Harrington, Ross W.; Ward, Michael D.","Complexes of Ag(I), Hg(I) and Hg(II) with multidentate pyrazolyl-pyridine ligands: From mononuclear complexes to coordination polymers via helicates, a mesocate, a cage and a catenate.","Dalton transactions (Cambridge, England : 2003)","2006","","42","4996","5013","10.1039/b607541j","","","0.71073","MoKα","","0.1758","0.1311","","","0.4124","0.4523","","","","","","1.703","","","","has coordinates","179779","2020-10-21","18:00:00",""
"7008367","7.6246","0.0015","26.37","0.004","44.091","0.006","90","","90","","90","","8865","3","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","Bis(2,6-bis(3-phenylpyrazol-1-yl)pyridine)iron(ii) ditetrafluoroborate, beta polymorph","Bis[2,6-bis{3-phenylpyrazol-1-yl}pyridine]iron(II) ditetrafluoroborate, beta polymorph","","- C46 H34 B2 F8 Fe N10 -","- C46 H34 B2 F8.14 Fe N10 -","- C368 H272 B16 F65.12 Fe8 N80 -","8","0.25","","Elhaik, Jerome; Evans, David J.; Kilner, Colin A.; Halcrow, Malcolm A.","A structural, magnetic and Mössbauer spectroscopic study of an unusual angular Jahn-Teller distortion in a series of high-spin iron(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2005","","9","1693","1700","10.1039/b502175h","","","0.71073","MoKα","","0.0568","0.0409","","","0.1113","0.1226","","","","","","1.048","","","","has coordinates,has disorder","179787","2020-10-21","18:00:00",""
"7009395","18.329","0.003","20.302","0.005","27.084","0.007","90","","90","","90","","10078","4","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","bis(ethane-1,2-amine)platinum(II) octacyanotungstate(V) tetrahydrate","","- C28 H56 N28 O4 Pt3 W2 -","- C28 H56 N28 O4 Pt3 W2 -","- C224 H448 N224 O32 Pt24 W16 -","8","0.25","","Robert Podgajny; Barbara Sieklucka; Wiesław Łasocha","Ternary adduct {[W(CN)8]3−,[Pt(en)2]2+,[W(CN)8]3−} in aqueous solution and crystal structure of [Pt(en)2]3[W(CN)8]2·4H2O with infinite linear WPt chains","J. Chem. Soc., Dalton Trans.","2000","","11","1799","1803","10.1039/b000645i","","","0.7093","","","0.0748","0.0574","","","0.1429","0.1499","","","","","","1.319","","","","has coordinates,has disorder","179797","2020-10-21","18:00:00",""
"7009435","23.7267","0.0016","23.8877","0.0017","30.6","0.002","90","","90","","90","","17343","2","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Hg2(imypyimy)2(PF6)4","","- C26 H26 F24 Hg2 N10 P4 -","- C26 H26 F24 Hg2 N10 P4 -","- C416 H416 F384 Hg32 N160 P64 -","16","0.5","","Chen, Jack C. C.; Lin, Ivan J. B.","The first dicarbene double helical mercury complex","Journal of the Chemical Society, Dalton Transactions","2000","","6","839","","10.1039/b000971g","","","0.71073","MoKα","","0.144","0.1239","","","0.2813","0.2918","","","","","","1.004","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7009593","10.9696","0.0002","23.0792","0.0005","23.3276","0.0006","90","","90","","90","","5905.8","0.2","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C20 H40 Cu4 Mo N6 S4 -","- C20 H40 Cu4 Mo N6 S4 -","- C160 H320 Cu32 Mo8 N48 S32 -","8","0.25","","Zhang, Chi; Song, Yinglin; Xu, Yan; Fun, Hoongkun; Fang, Guangyu; Wang, Yuxiao; Xin, Xinquan","Studies on two interesting microporous polymeric clusters {[Et4N]2[MS4Cu4(CN)4]}n (M = Mo or W) with three-dimensional open frameworks: synthesis, structural characterization, strong optical non-linearities and large optical limiting properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2823","","10.1039/b002164o","","","0.71073","MoKα","","0.0594","0.0435","","","0.1215","0.132","","","","","","1.042","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7009594","10.8968","0.0001","23.0553","0.0003","23.287","0.0001","90","","90","","90","","5850.37","0.1","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C20 H40 Cu4 N6 S4 W -","- C20 H40 Cu4 N6 S4 W -","- C160 H320 Cu32 N48 S32 W8 -","8","0.25","","Zhang, Chi; Song, Yinglin; Xu, Yan; Fun, Hoongkun; Fang, Guangyu; Wang, Yuxiao; Xin, Xinquan","Studies on two interesting microporous polymeric clusters {[Et4N]2[MS4Cu4(CN)4]}n (M = Mo or W) with three-dimensional open frameworks: synthesis, structural characterization, strong optical non-linearities and large optical limiting properties","Journal of the Chemical Society, Dalton Transactions","2000","","16","2823","","10.1039/b002164o","","","0.71073","MoKα","","0.039","0.0347","","","0.0896","0.0924","","","","","","1.041","","","","has coordinates,has disorder","179799","2020-10-21","18:00:00",""
"7010700","28.23","0.01","30.29","0.01","11.64","0.01","90","","90","","90","","9953","10","293.2","","293.2","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C18 H24 Mo N2 Na O10 -","- C36 H48 Mo N4 Na O20 -","- C288 H384 Mo8 N32 Na8 O160 -","8","0.25","","Smith, Paul D.; Cooney, J. Jon A.; McInnes, Eric J. L.; Beddoes, Roy L.; Collison, David; Harben, Spencer M.; Helliwell, Madeleine; Mabbs, Frank E.; Mandel, Alexander; Powell, Annie K.; Garner, C. David","New molybdenum(v) analogues of Amavadin and their redox properties","Journal of the Chemical Society, Dalton Transactions","2001","","20","3108","","10.1039/b102531g","","","1.5418","CuKα","","0.1355","0.0638","","0.0589","0.0532","","","","1.644","1.944","1.944","","","","","has coordinates","287753","2023-11-23","09:34:44",""
"7011320","14.8775","0.0002","25.9261","0.0002","36.3777","0.0002","90","","90","","90","","14031.4","0.2","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C18 H9 Ag3 O12 -","- C41.1429 H20.5714 Ag6.85714 O27.4286 -","- C576 H288 Ag96 O384 -","14","0.4375","","Daofeng Sun; Rong Cao; Jiabao Weng; Maochun Hong; Yucang Liang","A novel luminescent 3D polymer containing silver chains formed by ligand unsupported Ag‒Ag interactions and organic spacers","J. Chem. Soc., Dalton Trans.","2002","","3","291","292","10.1039/b110436e","","","0.71073","MoKα","","0.0599","0.0433","","","0.1016","0.1111","","","","","","1.003","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7012644","25.578","0.001","27.03","0.001","35.028","0.002","90","","90","","90","","24217.4","1.9","120","","120","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","(Ru(1,4-tppb)2)(PF6)2","","","- C60 H56 F12 N12 P2 Ru -","- C60 H56 F12 N12 P2 Ru -","- C960 H896 F192 N192 P32 Ru16 -","16","0.5","","Hazell, Alan; Hazell, Rita; McKenzie, Christine J.; Nielsen, Lars Preuss","Stepwise construction of mono-, di- and tri-nuclear 2 ? 1, 1 ? 2, 2 ? 3 ligand ? mixed-metal complexes using a bis-tridentate bridging ligand","Dalton Transactions","2003","","11","2203","","10.1039/b212624a","","","0.71073","MoKα","","","0.054","","","","0.058","","","","","","1.213","","","","has coordinates","179830","2020-10-21","18:00:00",""
"7012659","13.214","0.0002","21.7332","0.0004","28.7125","0.0005","90","","90","","90","","8245.7","0.2","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C17 H14 Cd N8 -","- C17 H14 Cd N8 -","- C272 H224 Cd16 N128 -","16","0.5","","Gao, En-Qing; Bai, Shi-Qiang; Wang, Zhe-Ming; Yan, Chun-Hua","One- and two-dimensional metal‒dicyanamido complexes with a flexible bridging co-ligand: structural and magnetic propertiesElectronic supplementary information (ESI) available: a scheme of the different bridging network topologies of dca complexes. See http://www.rsc.org/suppdata/dt/b2/b212886a/","Dalton Transactions","2003","","9","1759","","10.1039/b212886a","","","0.71073","MoKα","","0.065","0.0438","","","0.1272","0.1493","","","","","","1.084","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7014943","15.88","0.01","19.871","0.012","29.233","0.018","90","","90","","90","","9225","10","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C40 H52 Cl2 Ir2 N8 O12 -","- C40 H36 Cl2 Ir2 N8 O4 -","- C320 H288 Cl16 Ir16 N64 O32 -","8","0.25","","Davies, David L.; Lowe, Mark P.; Ryder, Karl S.; Singh, Kuldip; Singh, Shalini","Tuning emission wavelength and redox properties through position of the substituent in iridium(III) cyclometallated complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","5","1028","1030","10.1039/c0dt01311k","","","0.71073","MoKα","","0.0445","0.0308","","","0.0777","0.0824","","","","","","1.043","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7015745","19.798","0.002","23.098","0.002","32.469","0.003","90","","90","","90","","14848","2","153","2","153","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C52 H80 N24 Ni4 O24 -","- C52 H80 N24 Ni4 O24 -","- C416 H640 N192 Ni32 O192 -","8","0.25","","Anwar, Muhammad U.; Elliott, Andrew S.; Thompson, Laurence K.; Dawe, Louise N.","Complexes of functionally modified hydrazone ligands‒square, rectangular (M4), trigonal bipyramidal (M5) and pin-wheel (M6) motifs.","Dalton transactions (Cambridge, England : 2003)","2011","40","17","4623","4635","10.1039/c1dt10047e","","","0.71075","MoKα","","0.0713","0.0703","","","0.1706","0.1711","","","","","","1.207","","","","has coordinates","179861","2020-10-21","18:00:00",""
"7015891","26.1124","0.0003","28.8852","0.0004","29.5107","0.0005","90","","90","","90","","22258.8","0.6","100","2","100","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C40 H44 Cl Cu2 I9 N8 O2 -","- C40 H44 Cl Cu2 I9 N8 O2 -","- C640 H704 Cl16 Cu32 I144 N128 O32 -","16","0.5","","Bowmaker, Graham A.; Di Nicola, Corrado; Pettinari, Claudio; Skelton, Brian W.; Somers, Neil; White, Allan H.","Mechanochemical synthesis in copper(II) halide/pyridine systems: single crystal X-ray diffraction and IR spectroscopic studies.","Dalton transactions (Cambridge, England : 2003)","2011","40","18","5102","5115","10.1039/c1dt10224a","","","0.71073","MoKα","","0.0521","0.0252","","","0.0561","0.0648","","","","","","0.897","","","","has coordinates","179862","2020-10-21","18:00:00",""
"7017280","11.9427","0.0006","16.3128","0.0008","21.4984","0.0011","90","","90","","90","","4188.3","0.4","120","2","120","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","AS-12 2-(4-tolyl)-2,4-pentanedione, copper(II) tetrafluoroborate","","- C24 H26 Cu O4 -","- C24 H26 Cu O4 -","- C192 H208 Cu8 O32 -","8","0.25","","Aakeröy, Christer B; Sinha, Abhijeet S.; Chopade, Prashant D.; Desper, John","Halogen bonding or close packing? Examining the structural landscape in a series of Cu(ii)-acac complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","45","12160","12168","10.1039/c1dt10911a","","","0.71073","MoKα","","0.0315","0.0284","","","0.0858","0.0881","","","","","","1.057","","","","has coordinates","179876","2020-10-21","18:00:00",""
"7017281","11.9763","0.0007","15.8265","0.0009","21.7849","0.0011","90","","90","","90","","4129.2","0.4","120","2","120","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","D1 bis[2-(4-chlorophenyl)-2,4-pentanedionato]copper(II)","","- C22 H20 Cl2 Cu O4 -","- C22 H20 Cl2 Cu O4 -","- C176 H160 Cl16 Cu8 O32 -","8","0.25","","Aakeröy, Christer B; Sinha, Abhijeet S.; Chopade, Prashant D.; Desper, John","Halogen bonding or close packing? Examining the structural landscape in a series of Cu(ii)-acac complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","45","12160","12168","10.1039/c1dt10911a","","","0.71073","MoKα","","0.0294","0.0267","","","0.0852","0.0873","","","","","","1.109","","","","has coordinates","179876","2020-10-21","18:00:00",""
"7017282","12.0389","0.0011","15.8409","0.0012","22.1627","0.0017","90","","90","","90","","4226.6","0.6","120","2","120","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","AS-6 bis[2-(4-bromophenyl)-2,4-pentanedionato]copper(II)","","- C22 H20 Br2 Cu O4 -","- C22 H20 Br2 Cu O4 -","- C176 H160 Br16 Cu8 O32 -","8","0.25","","Aakeröy, Christer B; Sinha, Abhijeet S.; Chopade, Prashant D.; Desper, John","Halogen bonding or close packing? Examining the structural landscape in a series of Cu(ii)-acac complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","45","12160","12168","10.1039/c1dt10911a","","","0.71073","MoKα","","0.0501","0.0313","","","0.0737","0.0806","","","","","","1.037","","","","has coordinates","179876","2020-10-21","18:00:00",""
"7017300","23.5948","0.0016","36.253","0.003","38.053","0.003","90","","90","","90","","32550","4","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C72 H50 Cl2 Fe N10 O8 -","- C72 H50 Cl2 Fe N10 O8 -","- C1152 H800 Cl32 Fe16 N160 O128 -","16","0.5","","Bhaumik, Chanchal; Das, Shyamal; Maity, Dinesh; Baitalik, Sujoy","A terpyridyl-imidazole (tpy-HImzPh(3)) based bifunctional receptor for multichannel detection of Fe(2+) and F(-) ions.","Dalton transactions (Cambridge, England : 2003)","2011","40","44","11795","11808","10.1039/c1dt10965k","","","0.71073","MoKα","","0.1048","0.0664","","","0.2009","0.2247","","","","","","0.99","","","","has coordinates","179877","2020-10-21","18:00:00",""
"7017352","16.292","0.004","30.712","0.008","51.727","0.014","90","","90","","90","","25882","12","291","2","291","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C68 H50 N8 Ni3 O20 -","- C68 H50 N8 Ni3 O20 -","- C1088 H800 N128 Ni48 O320 -","16","0.5","","Wang, Feng; Ke, Xiaohuan; Zhao, Jinbo; Deng, Kejian; Leng, Xiaoke; Tian, Zhengfang; Wen, Lili; Li, Dongfeng","Six new metal-organic frameworks with multi-carboxylic acids and imidazole-based spacers: syntheses, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2011","40","44","11856","11865","10.1039/c1dt11130b","","","0.71073","MoKα","","0.07","0.0517","","","0.1369","0.1444","","","","","","1.059","","","","has coordinates,has disorder","179877","2020-10-21","18:00:00",""
"7017906","23.6887","0.0017","36.416","0.004","38.285","0.003","90","","90","","90","","33026","5","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C72 H50 Cl2 N10 O8 Ru -","- C72 H50 Cl2 N10 O8 Ru -","- C1152 H800 Cl32 N160 O128 Ru16 -","16","0.5","","Bhaumik, Chanchal; Das, Shyamal; Maity, Dinesh; Baitalik, Sujoy","Luminescent bis-tridentate ruthenium(ii) and osmium(ii) complexes based on terpyridyl-imidazole ligand: synthesis, structural characterization, photophysical, electrochemical, and solvent dependence studies.","Dalton transactions (Cambridge, England : 2003)","2012","41","8","2427","2438","10.1039/c1dt11645b","","","0.71073","MoKα","","0.1015","0.0603","","","0.1818","0.2186","","","","","","0.757","","","","has coordinates","179883","2020-10-21","18:00:00",""
"7017907","36.393","0.007","37.524","0.012","23.564","0.005","90","","90","","90","","32179","14","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C72 H50 Cl2 N10 O8 Os -","- C72 H50 Cl2 N10 O8 Os -","- C1152 H800 Cl32 N160 O128 Os16 -","16","0.5","","Bhaumik, Chanchal; Das, Shyamal; Maity, Dinesh; Baitalik, Sujoy","Luminescent bis-tridentate ruthenium(ii) and osmium(ii) complexes based on terpyridyl-imidazole ligand: synthesis, structural characterization, photophysical, electrochemical, and solvent dependence studies.","Dalton transactions (Cambridge, England : 2003)","2012","41","8","2427","2438","10.1039/c1dt11645b","","","0.71073","MoKα","","0.0895","0.0509","","","0.1253","0.1351","","","","","","1.03","","","","has coordinates","179883","2020-10-21","18:00:00",""
"7018804","17.598","0.0013","21.498","0.002","27.979","0.002","90","","90","","90","","10585.1","1.5","150","2","150","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C60.5 H57 B Cl Cu F4 N4 -","- C60 H56 B Cu F4 N4 -","- C480 H448 B8 Cu8 F32 N32 -","8","0.25","","Li, Lidong; Lopes, Patrícia S; Rosa, Vitor; Figueira, Cláudia A; Lemos, M Amélia N D A; Duarte, M. Teresa; Avilés, Teresa; Gomes, Pedro T.","Synthesis and structural characterisation of (aryl-BIAN)copper(i) complexes and their application as catalysts for the cycloaddition of azides and alkynes.","Dalton transactions (Cambridge, England : 2003)","2012","41","17","5144","5154","10.1039/c2dt11854h","","x-ray","0.71073","MoKα","","0.0618","0.046","","","0.1187","0.1265","","","","","","1.089","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7020567","17.215","0.003","18.088","0.004","44.671","0.008","90","","90","","90","","13910","5","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C21 H21 Cl Co N10 O6 P2 -","- C21 H21 Cl Co N10 O6 P2 -","- C336 H336 Cl16 Co16 N160 O96 P32 -","16","0.5","","Li, Xingjun; Jiang, Feilong; Chen, Lian; Wu, Mingyan; Chen, Qihui; Bu, Yang; Hong, Maochun","Three novel 3D coordination polymers based on a flexible multisite cyclotetraphosphazene ligand.","Dalton transactions (Cambridge, England : 2003)","2012","41","46","14038","14041","10.1039/c2dt31852k","","","0.71073","MoKα","","0.0611","0.0598","","","0.1832","0.1852","","","","","","1.083","","","","has coordinates","179909","2020-10-21","18:00:00",""
"7020568","17.3043","0.0005","18.3115","0.0007","45.7907","0.0017","90","","90","","90","","14509.6","0.9","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C21 H21 Cd Cl N10 O6 P2 -","- C21 H21 Cd Cl N10 O6 P2 -","- C336 H336 Cd16 Cl16 N160 O96 P32 -","16","0.5","","Li, Xingjun; Jiang, Feilong; Chen, Lian; Wu, Mingyan; Chen, Qihui; Bu, Yang; Hong, Maochun","Three novel 3D coordination polymers based on a flexible multisite cyclotetraphosphazene ligand.","Dalton transactions (Cambridge, England : 2003)","2012","41","46","14038","14041","10.1039/c2dt31852k","","","0.71073","MoKα","","0.062","0.0588","","","0.1837","0.1876","","","","","","1.081","","","","has coordinates","179909","2020-10-21","18:00:00",""
"7020764","16.0921","0.0013","27.479","0.0013","44.234","0.003","90","","90","","90","","19560","2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C28 H20 Cl2 N2 Pd -","- C28 H20 Cl2 N2 Pd -","- C896 H640 Cl64 N64 Pd32 -","32","1","","Hamm, Danielle C.; Braun, Lindsey A.; Burazin, Alex N.; Gauthier, Amanda M.; Ness, Kendra O.; Biebel, Casey E.; Sauer, Jon S.; Tanke, Robin; Noll, Bruce C.; Bosch, Eric; Bowling, Nathan P.","Conjugated metallorganic macrocycles: opportunities for coordination-driven planarization of bidentate, pyridine-based ligands.","Dalton transactions (Cambridge, England : 2003)","2013","42","4","948","958","10.1039/c2dt31914d","","","0.71073","MoKα","","0.0383","0.0262","","","0.0617","0.0682","","","","","","1.087","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7022352","13.1912","0.0019","20.076","0.003","32.596","0.005","90","","90","","90","","8632","2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C20 H22 N2 O4 Pd2 -","- C20 H22 N2 O4 Pd2 -","- C320 H352 N32 O64 Pd32 -","16","0.5","","Shishilov, Oleg N.; Akhmadullina, Nailya S.; Rezinkova, Yaroslavna N.; Podobedov, Roman E.; Churakov, Andrei V.; Efimenko, Inessa A.","Reactivity of polynuclear palladium carboxylate complexes towards acetonitrile: synthesis and X-ray study of Pd2(C6H4-o-C(=NH)CH3)2(CH3CO2)2 and Pd5(CH3C(=N)OC(=N)CH3)(NO)(NO2)x(RCO2)7-x.","Dalton transactions (Cambridge, England : 2003)","2013","42","10","3712","3720","10.1039/c2dt32407e","","","0.71073","MoKα","","0.0243","0.0204","","","0.0786","0.0821","","","","","","0.971","","","","has coordinates","179928","2020-10-21","18:00:00",""
"7023090","11.978","0.004","16.464","0.005","29.114","0.009","90","","90","","90","","5741","3","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C21 H12 Cl4 Fe2 N10 O -","- C21 H12 Cl4 Fe2 N10 O0.9996 -","- C168 H96 Cl32 Fe16 N80 O7.9968 -","8","0.25","","Alborés, Pablo; Rentschler, Eva","Expanding the 2,2'-bipyrimidine bridged 1D homonuclear coordination polymers family: [M(II)(bpym)Cl2] (M = Fe, Co) magnetic and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2013","42","26","9621","9627","10.1039/c3dt50691f","","","0.71069","MoKα","","0.0791","0.0584","","","0.1446","0.1525","","","","","","1.074","","","","has coordinates,has disorder","179935","2020-10-21","18:00:00",""
"7023091","11.7256","0.0014","16.5129","0.0019","29.182","0.003","90","","90","","90","","5650.3","1.1","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C21 H12 Cl4 Co2 N10 O -","- C21 H12 Cl4 Co2 N10 O -","- C168 H96 Cl32 Co16 N80 O8 -","8","0.25","","Alborés, Pablo; Rentschler, Eva","Expanding the 2,2'-bipyrimidine bridged 1D homonuclear coordination polymers family: [M(II)(bpym)Cl2] (M = Fe, Co) magnetic and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2013","42","26","9621","9627","10.1039/c3dt50691f","","","0.71069","MoKα","","0.1057","0.0788","","","0.1678","0.1739","","","","","","1.236","","","","has coordinates","179935","2020-10-21","18:00:00",""
"7023805","21.841","0.003","25.024","0.002","34.582","0.003","90","","90","","90","","18901","3","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C86 H82 F12 N10 O4 P2 Ru -","- C86 H82 F12 N10 O4 P2 Ru -","- C688 H656 F96 N80 O32 P16 Ru8 -","8","0.25","","Yang, Jiajia; Clegg, Jack K.; Jiang, Qibai; Lui, Xiaoming; Yan, Hong; Zhong, Wei; Beves, Jonathon E.","Multi-pyridine decorated Fe(ii) and Ru(ii) complexes by Pd(0)-catalysed cross couplings: new building blocks for metallosupramolecular assemblies.","Dalton transactions (Cambridge, England : 2003)","2013","42","44","15625","15636","10.1039/c3dt52331d","","","0.71073","MoKα","","0.0616","0.0514","","","0.1082","0.1092","","","","","","1.023","","","","has coordinates,has disorder","179943","2020-10-21","18:00:00",""
"7025983","29.533","0.006","39.637","0.008","42.832","0.009","90","","90","","90","","50139","18","153","2","153","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C64.5 H68 Li2 Nd O9.13 Si4 -","- C64.5 H68 Li2 Nd O9.125 Si4 -","- C2064 H2176 Li64 Nd32 O292 Si128 -","32","1","","Lorenz, Volker; Blaurock, Steffen; Hrib, Cristian G.; Edelmann, Frank T.","Encapsulation of cyclooctatetraenyl dianion in an unusual organic/inorganic lanthanide triple-decker sandwich complex.","Dalton transactions (Cambridge, England : 2003)","2010","39","29","6629","6631","10.1039/c0dt00094a","","","0.71073","MoKα","","0.1164","0.045","","","0.0997","0.115","","","","","","0.792","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7026911","11.4666","0.001","39.891","0.003","43.067","0.004","90","","90","","90","","19699","3","295","2","295","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C48 H36 N4 Ni2 O14.2 S4 -","- C48 H36 N4 Ni2 O14.2 S4 -","- C768 H576 N64 Ni32 O227.2 S64 -","16","0.5","","Li, Dong-Sheng; Fu, Feng; Zhao, Jun; Wu, Ya-Pan; Du, Miao; Zou, Kun; Dong, Wen-Wen; Wang, Yao-Yu","Unique 3D self-penetrating Co(II) and Ni(II) coordination frameworks with a new (4(4).6(10).8) network topology.","Dalton transactions (Cambridge, England : 2003)","2010","39","48","11522","11525","10.1039/c0dt00900h","","","0.71073","MoKα","","0.1151","0.0708","","","0.173","0.1884","","","","","","0.811","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7026912","11.4184","0.001","40.061","0.004","42.963","0.004","90","","90","","90","","19653","3","295","2","295","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C48 H36 Co2 N4 O14.2 S4 -","- C48 H36 Co2 N4 O14.2 S4 -","- C768 H576 Co32 N64 O227.2 S64 -","16","0.5","","Li, Dong-Sheng; Fu, Feng; Zhao, Jun; Wu, Ya-Pan; Du, Miao; Zou, Kun; Dong, Wen-Wen; Wang, Yao-Yu","Unique 3D self-penetrating Co(II) and Ni(II) coordination frameworks with a new (4(4).6(10).8) network topology.","Dalton transactions (Cambridge, England : 2003)","2010","39","48","11522","11525","10.1039/c0dt00900h","","","0.71073","MoKα","","0.0662","0.0415","","","0.0865","0.098","","","","","","1.053","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027884","27.1031","0.0004","34.9926","0.0001","43.0044","0.0005","90","","90","","90","","40785.7","0.8","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C80 H92 Eu2 N16 O33 -","- C71 H67 Eu2 N13 O30 -","- C1136 H1072 Eu32 N208 O480 -","16","0.5","","Bünzli, Jean-Claude G.; Ihringer, Frédéric; Dumy, Pascal; Sager, Cédric; Rogers, Robin D.","Structural and dynamic properties of calixarene bimetallic complexes: solution versus solid-state structure of dinuclear complexes of EuIII and LuIII with substituted calix[8]arenes †","Journal of the Chemical Society, Dalton Transactions","1998","","3","497","","10.1039/a706933b","","","0.71073","MoKα","","0.2032","0.0983","","0.3322","0.2521","","","","1.056","1.255","1.255","","","","","has coordinates,has disorder","179984","2020-10-21","18:00:00",""
"7028771","15.892","0.002","29.617","0.004","37.798","0.006","90","","90","","90","","17791","4","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C24 H34 Ag2 Al Mo6 N3 O33 -","- C24 H23 Ag2 Al Mo6 N3 O33 -","- C384 H368 Ag32 Al16 Mo96 N48 O528 -","16","0.5","","Hu, Ying; An, Haiyan; Liu, Xuan; Yin, Jiqiu; Wang, Huilong; Zhang, Hua; Wang, Lin","pH-controlled assembly of hybrid architectures based on Anderson-type polyoxometalates and silver coordination units.","Dalton transactions (Cambridge, England : 2003)","2014","43","6","2488","2498","10.1039/c3dt52987h","","","0.71073","MoKα","","0.0415","0.0359","","","0.0882","0.0914","","","","","","1.129","","","","has coordinates,has disorder","179993","2020-10-21","18:00:00",""
"7031452","19.6939","0.0004","27.4554","0.0004","41.4894","0.0009","90","","90","","90","","22433.5","0.7","113","2","113","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","poly[[pentakis-(N,N-dimethylformamide)(μ~10~- 1,3,5,7-tetrakis(5-tetrazolato)adamantane-tris-(μ-chlorido)-chlorido- tetracopper(II)] N,N-dimethylformamide solvate]","","- C32 H54 Cl4 Cu4 N22 O6 -","- C29 H47 Cl4 Cu4 N21 O5 -","- C464 H752 Cl64 Cu64 N336 O80 -","16","0.5","","Boldog, Ishtvan; Domasevitch, Konstantin V.; Sanchiz, Joaquín; Mayer, Peter; Janiak, Christoph","1,3,5,7-Tetrakis(tetrazol-5-yl)-adamantane: the smallest tetrahedral tetrazole-functionalized ligand and its complexes formed by reaction with anhydrous M(ii)Cl2 (M = Mn, Cu, Zn, Cd).","Dalton transactions (Cambridge, England : 2003)","2014","43","33","12590","12605","10.1039/c4dt01022a","","","0.71073","MoKα","","0.0747","0.0681","","","0.1931","0.1989","","","","","","1.066","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7031453","20.8726","0.0007","27.5137","0.0009","43.553","0.0013","90","","90","","90","","25011.7","1.4","113","2","113","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","poly[[heptakis-(N,N-dimethylformamide)(μ~10~- 1,3,5,7-tetrakis(5-tetrazolato)adamantane-tris-(μ-chlorido)-chlorido- tetracadmium(II)] N,N-dimethylformamide solvate]","","- C38 H68 Cd4 Cl4 N24 O8 -","- C38 H61 Cd4 Cl4 N24 O8 -","- C608 H976 Cd64 Cl64 N384 O128 -","16","0.5","","Boldog, Ishtvan; Domasevitch, Konstantin V.; Sanchiz, Joaquín; Mayer, Peter; Janiak, Christoph","1,3,5,7-Tetrakis(tetrazol-5-yl)-adamantane: the smallest tetrahedral tetrazole-functionalized ligand and its complexes formed by reaction with anhydrous M(ii)Cl2 (M = Mn, Cu, Zn, Cd).","Dalton transactions (Cambridge, England : 2003)","2014","43","33","12590","12605","10.1039/c4dt01022a","","","0.71073","MoKα","","0.075","0.0521","","","0.1359","0.1528","","","","","","1.033","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7032237","25.655","0.005","28.561","0.006","32.001","0.006","90","","90","","90","","23448","8","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C58 H43 Co3 N2 Na5 O28 -","- C58 H36 Co3 N4 Na5 O27 -","- C928 H576 Co48 N64 Na80 O432 -","16","0.5","","Chen, Wen-Xian; Tan, Li; Liu, Qiu-Ping; Qiang, Gen-Rong; Zhuang, Gui-Lin","The ionothermal synthesis, structure, and magnetism-structure relationship of two biphenyl tetracarboxylic acid-based metal-organic frameworks.","Dalton transactions (Cambridge, England : 2003)","2014","43","43","16515","16521","10.1039/c4dt02042a","","","0.71073","MoKα","","0.0942","0.0792","","","0.2172","0.2367","","","","","","1.058","","","","has coordinates","180028","2020-10-21","18:00:00",""
"7032748","13.978","0.005","18.737","0.007","34.854","0.012","90","","90","","90","","9128","6","90","2","90","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C56 H66 Cd -","- C56 H66 Cd -","- C448 H528 Cd8 -","8","0.25","","Blundell, Toby J.; Hastings, Fiona R.; Gridley, Benjamin M.; Moxey, Graeme J.; Lewis, William; Blake, Alexander J.; Kays, Deborah L.","Ligand influences on homoleptic Group 12 m-terphenyl complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","38","14257","14264","10.1039/c4dt00647j","","","0.71073","MoKα","","0.0295","0.0275","","","0.0713","0.0733","","","","","","1.095","","","","has coordinates","180033","2020-10-21","18:00:00",""
"7032749","13.998","0.003","18.67","0.004","34.919","0.008","90","","90","","90","","9126","3","90","2","90","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C56 H66 Hg -","- C56 H66 Hg -","- C448 H528 Hg8 -","8","0.25","","Blundell, Toby J.; Hastings, Fiona R.; Gridley, Benjamin M.; Moxey, Graeme J.; Lewis, William; Blake, Alexander J.; Kays, Deborah L.","Ligand influences on homoleptic Group 12 m-terphenyl complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","38","14257","14264","10.1039/c4dt00647j","","","0.71073","MoKα","","0.0313","0.0254","","","0.0619","0.0648","","","","","","1.047","","","","has coordinates","180033","2020-10-21","18:00:00",""
"7033086","15.1594","0.0006","21.5153","0.0008","43.7045","0.0017","90","","90","","90","","14254.6","1","100","2","100","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","[Cu4(u-Cl)6(DPFN)2][Cl]2","","","- C70 H64 Cl8 Cu4 F4 N12 O4 -","- C70.02 H64.16 Cl8 Cu4 F4 N12 O4.02 -","- C560.16 H513.28 Cl64 Cu32 F32 N96 O32.16 -","8","0.25","","Davenport, T. C.; Tilley, T. D.","Dinuclear first-row transition metal complexes with a naphthyridine-based dinucleating ligand.","Dalton transactions (Cambridge, England : 2003)","2015","44","27","12244","12255","10.1039/c4dt02727b","","","0.71073","MoKα","","0.0754","0.0488","","","0.1318","0.1526","","","","","","1.066","","","","has coordinates,has disorder","180036","2020-10-21","18:00:00",""
"7033308","55.192","0.011","62.235","0.012","80.147","0.016","90","","90","","90","","275295","9","223","2","223","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C360 H464 Cd24 Eu8 N24 O144 -","- C360 H464 Cd24 Eu8 N24 O144 -","- C5760 H7424 Cd384 Eu128 N384 O2304 -","16","0.5","","Brown, Katherine A.; Yang, Xiaoping; Schipper, Desmond; Hall, Justin W.; DePue, Lauren J.; Gnanam, Annie J.; Arambula, Jonathan F.; Jones, Jessica N.; Swaminathan, Jagannath; Dieye, Yakhya; Vadivelu, Jamuna; Chandler, Don J.; Marcotte, Edward M.; Sessler, Jonathan L.; Ehrlich, Lauren I. R.; Jones, Richard A.","A self-assembling lanthanide molecular nanoparticle for optical imaging.","Dalton transactions (Cambridge, England : 2003)","2015","44","6","2667","2675","10.1039/c4dt02646b","","","0.710747","MoKα","","0.15","0.0862","","","0.2309","0.2713","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7033661","21.4696","0.0013","21.4696","0.0013","29.3995","0.0017","90","","90","","90","","13551.5","1.4","180","2","180","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C32 H48 Al Li N8 -","- C32 H48 Al Li N8 -","- C512 H768 Al16 Li16 N128 -","16","0.5","","Less, Robert J.; Allen, Lucy K.; Steiner, Alexander; Wright, Dominic S.","Multiple deprotonation of primary aromatic diamines by LiAlH4.","Dalton transactions (Cambridge, England : 2003)","2015","44","9","4141","4147","10.1039/c4dt03802a","","","1.54184","CuKα","","0.1388","0.1034","","","0.2653","0.2892","","","","","","1.003","","","","has coordinates","180042","2020-10-21","18:00:00",""
"7034028","8.6068","0.0003","24.6534","0.001","35.7404","0.0016","90","","90","","90","","7583.6","0.5","295","2","295","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C15 H22 Ag N5 O4 -","- C15 H22 Ag N5 O4 -","- C240 H352 Ag16 N80 O64 -","16","0.5","","Huang, Jing; Deng, Zhao-Peng; Xiao, Ying-Hui; Huo, Li-Hua; Zhao, Shu-Nan; Ge, Fa-Yuan; Gao, Shan","Macrocyclic dinuclear, helical, layered and 3-D Ag(i) complexes constructed from AgX (X = NO3(-) and ClO4(-)) and flexible bis(pyridyl) ligands with a chelating spacer: syntheses, structures and photoluminescence properties.","Dalton transactions (Cambridge, England : 2003)","2015","44","12","5837","5847","10.1039/c5dt00265f","","","0.71073","MoKα","","0.1139","0.0764","","","0.2179","0.2426","","","","","","1.028","","","","has coordinates,has disorder","180046","2020-10-21","18:00:00",""
"7034029","24.365","0.0018","8.6123","0.0007","36.092","0.003","90","","90","","90","","7573.5","1","295","2","295","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C15 H22 Ag Cl N4 O5 -","- C15 H22 Ag Cl N4 O5 -","- C240 H352 Ag16 Cl16 N64 O80 -","16","0.5","","Huang, Jing; Deng, Zhao-Peng; Xiao, Ying-Hui; Huo, Li-Hua; Zhao, Shu-Nan; Ge, Fa-Yuan; Gao, Shan","Macrocyclic dinuclear, helical, layered and 3-D Ag(i) complexes constructed from AgX (X = NO3(-) and ClO4(-)) and flexible bis(pyridyl) ligands with a chelating spacer: syntheses, structures and photoluminescence properties.","Dalton transactions (Cambridge, England : 2003)","2015","44","12","5837","5847","10.1039/c5dt00265f","","","0.71073","MoKα","","0.0788","0.0521","","","0.1283","0.1493","","","","","","1.02","","","","has coordinates","180046","2020-10-21","18:00:00",""
"7035503","11.1423","0.00014","26.799","0.0003","38.4479","0.0005","90","","90","","90","","11480.6","0.2","120","","120","","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C24 H61 Au2 N4 Na6 O29 S8 -","- C24 H61 Au2 N4 Na6 O29 S8 -","- C192 H488 Au16 N32 Na48 O232 S64 -","8","0.25","","Hapka, Michał; Dranka, Maciej; Orłowska, Katarzyna; Chałasiński, Grzegorz; Szczęśniak, Małgorzata M; Zachara, Janusz","Noncovalent interactions determine the conformation of aurophilic complexes with 2-mercapto-4-methyl-5-thiazoleacetic acid ligands.","Dalton transactions (Cambridge, England : 2003)","2015","44","30","13641","13650","10.1039/c5dt01627d","","x-ray","1.54184","CuKα","","0.0466","0.046","","","0.1094","0.1096","","","","","","1.375","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44",""
"7040494","11.362","0.002","41.867","0.008","26.271","0.005","90","","90","","90","","12497","4","143","1","143","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C64 H80 Ce Li4 N8 O4 -","- C64 H80 Ce Li4 N8 O4 -","- C512 H640 Ce8 Li32 N64 O32 -","8","0.25","","Levin, Jessica R.; Cheisson, Thibault; Carroll, Patrick J.; Schelter, Eric J.","Accessing relatively electron poor cerium(iv) hydrazido complexes by lithium cation promoted ligand reduction.","Dalton transactions (Cambridge, England : 2003)","2016","45","38","15249","15258","10.1039/c6dt03154d","","","0.71073","MoKα","","0.0171","0.0164","","","0.0421","0.043","","","","","","1.128","","","","has coordinates","187077","2020-10-21","18:00:00",""
"7042464","16.301","0.016","20.61","0.004","48.31","0.04","90","","90","","90","","16230","2","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C29 H59 B Cl6 N2 Zr2 -","- C29 H57 B Cl6 N2 Zr2 -","- C464 H912 B16 Cl96 N32 Zr32 -","16","0.5","","Greño, Maider; Mena, Miguel; Pérez-Redondo, Adrián; Yélamos, Carlos","Isolable zirconium hydride species in the reaction of amido complexes with amine-boranes.","Dalton transactions (Cambridge, England : 2003)","2017","46","16","5138","5142","10.1039/c7dt00857k","","x-ray","0.71073","MoKα","","0.0705","0.0502","","","0.0945","0.104","","","","","","1.115","","","","has coordinates,has disorder","196430","2020-10-21","18:00:00",""
"7042529","16.6743","0.0015","20.8855","0.0018","20.8865","0.0019","90","","90","","90","","7273.7","1.1","298","2","298","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- Cu H2 I3 O2 Pb2 -","- Cu H2 I3 O2 Pb2 -","- Cu32 H64 I96 O64 Pb64 -","32","1","","Xue, Ying-Ying; Zhang, Li-Xia; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng; Zhai, Quan-Guo","Ionothermal synthesis of novel Pb-OH-Cu-X (X = Cl, Br and I) quaternary heterometallic frameworks with tunable optical properties.","Dalton transactions (Cambridge, England : 2003)","2017","46","16","5183","5188","10.1039/c7dt00712d","","","0.71073","MoKα","","0.0554","0.0456","","","0.1125","0.1167","","","","","","1.096","","","","has coordinates","196420","2020-10-21","18:00:00",""
"7045624","9.8816","0.0012","12.6499","0.0015","14.872","0.002","90","","90","","90","","1859","0.4","240","","240","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Al B4 H20 N -","- Al B4 H20 N -","- Al8 B32 H160 N8 -","8","0.25","","Starobrat, A.; Jaroń, T; Grochala, W.","New hydrogen-rich ammonium metal borohydrides, NH<sub>4</sub>[M(BH<sub>4</sub>)<sub>4</sub>], M = Y, Sc, Al, as potential H<sub>2</sub> sources.","Dalton transactions (Cambridge, England : 2003)","2018","47","13","4442","4448","10.1039/c7dt03926c","powder diffraction","x-ray","1.54187","CuKα","","0.0653","0.0604","","0.0423","0.0421","","","","1.45","","","","","","","has coordinates","229748","2020-10-21","18:00:00",""
"7045915","18.093","0.004","30.534","0.006","32.837","0.007","90","","90","","90","","18141","7","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C26 H68 Ge Si10 -","- C26 H68 Ge Si10 -","- C416 H1088 Ge16 Si160 -","16","0.5","","Walewska, Małgorzata; Baumgartner, Judith; Marschner, Christoph; Albers, Lena; Müller, Thomas","Spirocyclic germanes via transannular insertion reactions of vinyl germylenes into Si-Si bonds.","Dalton transactions (Cambridge, England : 2003)","2018","47","17","5985","5996","10.1039/c8dt00315g","","","0.71073","MoKα","","0.023","0.022","","","0.0597","0.0602","","","","","","1.078","","","","has coordinates","229556","2020-10-21","18:00:00",""
"7049910","11.3046","0.0016","23.157","0.003","33.145","0.005","90","","90","","90","","8677","2","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C40 H68 Ag4 N8 -","- C40 H68 Ag4 N8 -","- C320 H544 Ag32 N64 -","8","0.25","","Tong, Liuchuan; Davis, Luke M.; Gong, Xian; Feng, Jun; Beh, Eugene S.; Gordon, Roy G.","Synthesis of volatile, reactive coinage metal 5,5-bicyclic amidinates with enhanced thermal stability for chemical vapor deposition.","Dalton transactions (Cambridge, England : 2003)","2019","48","20","6709","6713","10.1039/c9dt01202h","","","0.71073","MoKα","","0.0459","0.0201","","","0.0325","0.036","","","","","","0.921","","","","has coordinates,has disorder","224222","2020-10-21","18:00:00",""
"7050498","8.3261","0.0006","31.196","0.002","31.772","0.002","90","","90","","90","","8252.5","1","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","2,3,5,6-Tetramesityl-1,4-di-iodobenzene.0.5toluene","","","- C45.5 H48 I2 -","- C45.5 H44 I2 -","- C364 H352 I16 -","8","0.25","","Shah, Shashin; Eichler, Barrett E.; Smith, Rhett C.; Power, Philip P.; Protasiewicz, John D.","Synthesis and solid state structures of increasingly sterically crowded 1,4-diiodo-2,3,5,6-tetraarylbenzenes: a new series of bulky benzenes and aryls","New Journal of Chemistry","2003","27","2","442","","10.1039/b210577b","","","0.71073","MoKα","","0.0928","0.0567","","","0.1268","0.1385","","","","","","1.077","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050931","13.214","0.0002","21.7332","0.0004","28.7125","0.0005","90","","90","","90","","8245.7","0.2","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C17 H14 Cd N8 -","- C17 H14 Cd N8 -","- C272 H224 Cd16 N128 -","16","0.5","","Gao, En-Qing; Wang, Zhe-Ming; Liao, Chun-Sheng; Yan, Chun-Hua","Topological isomerism in the formation of a novel three-dimensional metal-organic polycatenane","New Journal of Chemistry","2002","26","9","1096","","10.1039/b204324f","","","0.71073","MoKα","","0.065","0.0438","","","0.1272","0.1493","","","","","","1.084","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7052621","16.5749","0.0019","18.395","0.002","22.912","0.003","90","","90","","90","","6985.8","1.4","291","2","291","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C20 H14 N4 O4 Zn -","- C20 H14 N4 O4 Zn -","- C320 H224 N64 O64 Zn16 -","16","0.5","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.0359","0.0313","","","0.0855","0.0882","","","","","","1.079","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052804","24.921","0.004","25.341","0.004","41.507","0.007","90","","90","","90","","26213","7","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C52 H108 Lu N9 O6 S4 -","- C52 H108 Lu N9 O6 S4 -","- C832 H1728 Lu16 N144 O96 S64 -","16","0.5","","Lozano-Rodriguez, M. J.; Copping, R.; Petit, S.; Solari, P. L.; Guilbaud, P.; Mustre de Leon, J.; Den Auwer, C.","Crystal structure versus solution for two new lutetium thiocyanato complexes","New Journal of Chemistry","2011","35","12","2755","","10.1039/c1nj20494g","","","0.71073","MoKα","","0.0324","0.028","","","0.0723","0.0761","","","","","","1.056","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7054967","9.6867","0.0019","15.449","0.003","27.303","0.006","90","","90","","90","","4085.9","1.4","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C5 H10 Gd O10 -","- C5 H10 Gd O10 -","- C80 H160 Gd16 O160 -","16","0.5","","Liu, Sui-Jun; Zheng, Teng-Fei; Bao, Jun; Dong, Piao-Ping; Liao, Jin-Sheng; Chen, Jing-Lin; Wen, He-Rui; Xu, Jian; Bu, Xian-He","Two GdIIIcomplexes derived from dicarboxylate ligands as cryogenic magnetorefrigerants","New J. Chem.","2015","39","9","6970","","10.1039/C5NJ01229E","","","0.71073","MoKα","","0.0285","0.0244","","","0.0432","0.0444","","","","","","1.167","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7058853","21.821","0.004","25.478","0.005","40.301","0.008","90","","90","","90","","22406","7","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C104 H94 Eu2 N4 O16 -","- C104 H88 Eu2 N4 O16 -","- C832 H704 Eu16 N32 O128 -","8","0.25","","Xu, Yuan-Yi; Sun, Ou; Qi, Yue; Xie, Bo-Yu; Gao, Ting","Enhanced luminescence for detection of small molecules based on doped lanthanide compounds with a dinuclear double-stranded helicate structure","New Journal of Chemistry","2019","43","42","16706","","10.1039/C9NJ04104D","","","0.71073","MoKα","","0.1034","0.0686","","","0.2067","0.2282","","","","","","1.119","","","","has coordinates","224781","2020-10-21","18:00:00",""
"7058996","13.1578","0.0005","33.0511","0.0013","40.2845","0.0016","90","","90","","90","","17518.9","1.2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C28 H16 Fe N6 S10 -","- C28 H16 Fe N6 S10 -","- C448 H256 Fe16 N96 S160 -","16","0.5","","Bechu, Damien; Rogez, Guillaume; Hosseini, Mir Wais; Baudron, Stéphane A.","Tetrathiopyridyl-tetrathiafulvalene-based Cd(ii) coordination polymers: one ligand, one metal cation, many possibilities","New Journal of Chemistry","2019","43","36","14291","","10.1039/C9NJ03572A","","","0.71073","MoKα","","0.0404","0.0318","","","0.0813","0.0866","","","","","","1.037","","","","has coordinates","223417","2020-10-21","18:00:00",""
"7058997","13.2346","0.0009","32.997","0.002","40.42","0.003","90","","90","","90","","17651","2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C28 H16 Mn N6 S10 -","- C28 H16 Mn N6 S10 -","- C448 H256 Mn16 N96 S160 -","16","0.5","","Bechu, Damien; Rogez, Guillaume; Hosseini, Mir Wais; Baudron, Stéphane A.","Tetrathiopyridyl-tetrathiafulvalene-based Cd(ii) coordination polymers: one ligand, one metal cation, many possibilities","New Journal of Chemistry","2019","43","36","14291","","10.1039/C9NJ03572A","","","0.71073","MoKα","","0.1121","0.0604","","","0.1721","0.1989","","","","","","1.033","","","","has coordinates","223417","2020-10-21","18:00:00",""
"7058998","13.1462","0.0008","33.0327","0.0017","40.021","0.003","90","","90","","90","","17379.3","1.9","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C28 H16 Co N6 S10 -","- C28 H16 Co N6 S10 -","- C448 H256 Co16 N96 S160 -","16","0.5","","Bechu, Damien; Rogez, Guillaume; Hosseini, Mir Wais; Baudron, Stéphane A.","Tetrathiopyridyl-tetrathiafulvalene-based Cd(ii) coordination polymers: one ligand, one metal cation, many possibilities","New Journal of Chemistry","2019","43","36","14291","","10.1039/C9NJ03572A","","","0.71073","MoKα","","0.0809","0.0488","","","0.1347","0.1534","","","","","","1.058","","","","has coordinates","223417","2020-10-21","18:00:00",""
"7058999","13.5247","0.0008","33.182","0.004","41.083","0.005","90","","90","","90","","18437","3","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C29 H17 Cd Cl3 N6 S10 -","- C29 H17 Cd Cl3 N6 S10 -","- C464 H272 Cd16 Cl48 N96 S160 -","16","0.5","","Bechu, Damien; Rogez, Guillaume; Hosseini, Mir Wais; Baudron, Stéphane A.","Tetrathiopyridyl-tetrathiafulvalene-based Cd(ii) coordination polymers: one ligand, one metal cation, many possibilities","New Journal of Chemistry","2019","43","36","14291","","10.1039/C9NJ03572A","","","0.71073","MoKα","","0.0788","0.0582","","","0.1813","0.2033","","","","","","1.084","","","","has coordinates,has disorder","223417","2020-10-21","18:00:00",""
"7059322","15.4094","0.0013","16.5616","0.0014","46.034","0.004","90","","90","","90","","11748.1","1.7","273","2","273","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","Cobalt-organic Compound","","","- C14 H12 Co0.5 N2 O3 S2 -","- C14 H12 Co0.5 N2 O3 S2 -","- C448 H384 Co16 N64 O96 S64 -","32","1","","Daga, Pooja; Majee, Prakash; Singha, Debal Kanti; Manna, Priyanka; Hui, Sayani; Ghosh, Ananta Kumar; Mahata, Partha; Mondal, Sudip Kumar","Dramatic luminescence signal from a Co(ii)-based metal‒organic compound due to the construction of charge-transfer bands with Al3+ and Fe3+ ions in water: steady-state and time-resolved spectroscopic studies","New Journal of Chemistry","2020","44","11","4376","4385","10.1039/D0NJ00295J","","","0.71073","MoKα","","0.0601","0.0458","","","0.1129","0.1227","","","","","","0.896","","","","has coordinates","257893","2020-10-21","18:00:00",""
"7061446","8.9617","0.0012","19.198","0.003","40.595","0.007","90","","90","","90","","6984.2","1.9","113","","113","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","[Cd(dbta)]n","","- C23 H13 Cd N3 O4 -","- C23 H13 Cd N3 O4 -","- C368 H208 Cd16 N48 O64 -","16","0.5","","Liu, Lu; Jia, Yuejiao; Chen,; Li, Dechao; Hu, Ming","A multifunctional fluorescent Cd-MOF probe: its synthesis, structure, and sensing properties","New Journal of Chemistry","2022","46","18","8636","8643","10.1039/D2NJ00358A","","","0.71073","MoKα","","0.0535","0.0369","","","0.0793","0.0869","","","","","","1.121","","","","has coordinates","275807","2022-06-06","01:56:50",""
"7062339","16.8702","0.0005","42.406","0.002","33.8869","0.0013","90","","90","","90","","24242.6","1.6","150","2","149.9","0.6","","","","","","","","9","F d d d :2","-F 2uv 2vw","70","","","","- C54 H56 Co F6 Fe2 N2 O2 P3 S4 -","- C54 H56 Co F6 Fe2 N2 O2 P3 S4 -","- C864 H896 Co16 F96 Fe32 N32 O32 P48 S64 -","16","0.5","","Srivastava, Devyani; Singh, Amita; Kociok-Köhn, Gabriele; Gosavi, Suresh W.; Chauhan, Ratna; Ashokkumar, Muthupandian; Kumar, Abhinav; Muddassir, Mohd.","New heteroleptic 1,2-bis(diphenylphosphino)ethane appended cobalt(iii) ferrocene dithiocarbamates as sensitizers in dye-sensitized solar cells (DSSCs)","New Journal of Chemistry","2023","47","13","6420","6432","10.1039/D2NJ04736E","","x-ray","0.71073","MoKα","","0.1071","0.0883","","","0.2182","0.2305","","","","","","1.069","","","","has coordinates,has disorder","283392","2023-05-05","02:55:23",""
"7100132","8.728","0.003","18.451","0.007","49.722","0.017","90","","90","","90","","8007","5","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C44 H28 Cu2 N8 O8 -","- C88 H56 Cu4 N16 O22 -","- C352 H224 Cu16 N64 O88 -","4","0.125","","George Newkome; Charles N. Moorefield; Matthew Panzer; Pingshan Wang.","Terpyridine copperII-polycarboxylic acid architectures: formation of dimeric, helical, and cyclic nanostructures and their included-water molecule motifs","Chemical Communications","2005","","","","","10.1039/b505327g","","","","","","","","","","","","","","","","","","","","","has coordinates","180103","2020-10-21","18:00:00",""
"7100186","8.755","0.0003","20.7786","0.0007","34.4075","0.0013","90","","90","","90","","6259.3","0.4","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 O12 Sc2 -","- C24 H12 O12.128 Sc2 -","- C192 H96 O97.024 Sc16 -","8","0.25","","S.R.Miller; P.A.Wright; C.Serre; T.Loiseau; J.Marrot; G.Ferey","A microporous scandium terephthalate, Sc~2~(O~2~CC~6~H~4~CO~2~)~3~, with high thermal stability","Chemical Communications","2005","","","","","10.1039/b506677h","","","","","","","","","","","","","","","","","","","","","has coordinates","180103","2020-10-21","18:00:00",""
"7100347","8.071","0.002","11.127","0.003","48.264","0.014","90","","90","","90","","4335","2","219","2","219","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C22 H8 Cu2 F10 N2 -","- C22 H8 Cu2 F10 N2 -","- C176 H64 Cu16 F80 N16 -","8","0.25","","Frieder Jaekle; Arnold Rheingold; Anand Sundararaman; Lev N. Zakharov","Competition of Cuprophilic and p-Stacking Interactions in the Formation of Supramolecular Stacks from Organocopper Complexes","Chemical Communications","2005","","","","","10.1039/b417532h","","","","","","","","","","","","","","","","","","","","","has coordinates","180105","2020-10-21","18:00:00",""
"7102042","15.8027","0.0014","62.629","0.006","76.415","0.007","90","","90","","90","","75628","12","120","1","120","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C228 H256 Fe4 N16 O52 Pt16 -","- C228 H248 Fe4 N16 O52 Pt16 -","- C1824 H1984 Fe32 N128 O416 Pt128 -","8","0.25","","Ohashi, Masato; Yagyu, Akihiro; Yamagata, Tsuneaki; Mashima, Kazushi","Tetraplatinum precursors for supramolecular assemblies: syntheses, crystal structures, and stereoselective self-assemblies of [Pt4(micro-OCOCH3)6(kappa4-N4-DArBp)] (DArBp = 1,3-bis(arylbenzamidinate)propane).","Chemical communications (Cambridge, England)","2007","","29","3103","3105","10.1039/b703730a","","","0.71075","MoKα","","0.2413","0.0808","","","0.2284","0.3098","","","","","","0.95","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102068","15.4885","0.001","26.9605","0.0017","35.32","0.002","90","","90","","90","","14748.9","1.6","100","","100","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C42 H36 Ga10 N6 S16 -","- C41.9996 H36 Ga10 N6.0004 S16 -","- C335.997 H288 Ga80 N48.0032 S128 -","8","0.25","","Vaqueiro, Paz; Romero, M Lucia","[Ga10S16(NC7H9)(4)](2-): a hybrid supertetrahedral nanocluster.","Chemical communications (Cambridge, England)","2007","","31","3282","3284","10.1039/b704724j","","","0.71073","MoKα","","0.1251","0.0451","","0.0832","0.0535","0.0535","","","","","","1.0385","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102141","15.7443","0.0019","16.574","0.002","21.682","0.003","90","","90","","90","","5658.1","1.2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","tetra-(2,3,4-trifluorobenzoato-O,O')-tetracopper(I,I,I,I)","tetra-(2,3,4-trifluorobenzoato-O,O')-tetracopper(I,I,I,I)","","- C28 H8 Cu4 F12 O8 -","- C28 H8 Cu4 F12 O8 -","- C224 H64 Cu32 F96 O64 -","8","0.25","","Sevryugina, Yulia; Hietsoi, Oleksandr; Petrukhina, Marina A.","Tetranuclear copper(I) clusters: impact of bridging carboxylate ligands on solid state structure and photoluminescence","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3853","3855","10.1039/b707957e","","","0.71073","MoKα","","0.0542","0.039","","","0.0967","0.1074","","","","","","1.015","","","","has coordinates","210725","2020-10-21","18:00:00",""
"7104653","16.247","0.006","48.939","0.019","80.84","0.03","90","","90","","90","","64280","43","253","2","253","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","Yb-PVDC-1","","","- C39 H30 O10 Yb -","- C39 H30 O10 Yb -","- C1248 H960 O320 Yb32 -","32","1","","White, Kiley A; Chengelis, Demetra A; Zeller, Matthias; Geib, Steven J; Szakos, Jessica; Petoud, Stéphane; Rosi, Nathaniel L","Near-infrared emitting ytterbium metal-organic frameworks with tunable excitation properties.","Chemical communications (Cambridge, England)","2009","34","30","4506","4508","10.1039/b909658b","","x-ray","0.71073","MoKα","","0.1599","0.0575","","","0.1252","0.1484","","","","","","0.884","","","","has coordinates","180149","2020-10-21","18:00:00",""
"7105598","18.6001","0.0008","28.4944","0.0011","54.266","0.002","90","","90","","90","","28761","2","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C162 H154 Co8 N18 O24 -","- C163 H155 Co8 N17 O24 -","- C1304 H1240 Co64 N136 O192 -","8","0.25","","Atwood, Jerry L.; Brechin, Euan K.; Dalgarno, Scott J.; Inglis, Ross; Jones, Leigh F.; Mossine, Andrew; Paterson, Martin J.; Power, Nicholas P.; Teat, Simon J.","Magnetism in metal‒organic capsules","Chemical Communications","2010","46","20","3484","","10.1039/c002247k","","","0.7749","synchrotron","","0.0856","0.0531","","","0.1341","0.1572","","","","","","1.051","","","","has coordinates,has disorder","180159","2020-10-21","18:00:00",""
"7105599","19.7468","0.0009","27.6774","0.0013","53.647","0.003","90","","90","","90","","29320","3","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C161 H155 N19 Ni8 O24 -","- C161 H155 N19 Ni8 O24 -","- C1288 H1240 N152 Ni64 O192 -","8","0.25","","Atwood, Jerry L.; Brechin, Euan K.; Dalgarno, Scott J.; Inglis, Ross; Jones, Leigh F.; Mossine, Andrew; Paterson, Martin J.; Power, Nicholas P.; Teat, Simon J.","Magnetism in metal‒organic capsules","Chemical Communications","2010","46","20","3484","","10.1039/c002247k","","","0.7749","synchrotron","","0.0848","0.063","","","0.1806","0.2007","","","","","","1.04","","","","has coordinates,has disorder","180159","2020-10-21","18:00:00",""
"7105695","19.2396","0.0009","20.3017","0.0009","46.143","0.002","90","","90","","90","","18023.3","1.4","298","2","298","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C14 H9 In N0 O6 -","- C14 H8 In O6 -","- C448 H256 In32 O192 -","32","1","","Zhao Jin; Huan-Yu Zhao; Xiao-Jun Zhao; Qiqn-Rong Fang; Jeffrey Long; Guang-Shan Zhu","A novel 3D metal–organic framework (MOF) with 2D rhombic channels: C14 H9 In N0 O6","Chem.Commun.","2010","46","","8612","","10.1039/c0cc01031f","","","0.71073","MoKα","","0.0788","0.0698","","","0.2191","0.2274","","","","","","1","","","","has coordinates","180160","2020-10-21","18:00:00",""
"7105705","7.6932","0.0005","16.021","0.0011","22.1017","0.0015","90","","90","","90","","2724.1","0.3","150","2","150","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H16 N6 Zn -","- C12 H16 N6 Zn -","- C96 H128 N48 Zn8 -","8","0.25","","Carl Redshaw; Surajit Jana; Congxiao Shang; Mark Elsegood; Xuesong Lu; Zhengxiao Guo","Enhancement of H2 uptake via fluorination but not lithiation for Zn4N8 and Zn4N6O type clusters.","Chem.Commun.","2010","46","","9055","","10.1039/c0cc03380d","","","0.8457","synchrotron","","0.0268","0.0262","","","0.068","0.0685","","","","","","1.073","","","","has coordinates","180161","2020-10-21","18:00:00",""
"7105826","19.4031","0.0002","20.095","0.0002","46.4769","0.0006","90","","90","","90","","18121.6","0.3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C30 H32 In2 N2 O14 -","- C33 H23 In2 N2 O15 -","- C528 H368 In32 N32 O240 -","16","0.5","","Yan-Xi Tan; Fei Wang; Yao Kang; Jian Zhang","Dynamic microporous indium(III)-4,4?-oxybis(benzoate) framework with high selectivity for the adsorption of CO2 over N2","Chem.Commun.","2011","47","","770","","10.1039/c0cc04095a","","","0.71073","MoKα","","0.0629","0.0415","","","0.1368","0.1527","","","","","","1.133","","","","has coordinates","180162","2020-10-21","18:00:00",""
"7107234","15.3","0.002","26.902","0.004","31.342","0.005","90","","90","","90","","12900","3","110","2","110","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H10 In N2 O8 -","- C16 H10 In N2 O8 -","- C256 H160 In16 N32 O128 -","16","0.5","","Bizhen Yuan; Deyun Ma; Xi Wang; Zhong Li; Yingwei Li; Huimin Liu; Dehua He","A microporous, moisture-stable, and amine-functionalized metal-organic framework for highly selective separation of CO2 from CH4","Chem.Commun.","2012","48","","1135","","10.1039/c2cc16923a","","","0.71073","MoKα","","0.0342","0.0278","","","0.0758","0.0778","","","","","","1.073","","","","has coordinates","288505","2023-12-22","15:12:03",""
"7107567","7.8304","0.0016","26.31","0.005","30.543","0.006","90","","90","","90","","6292","2","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H7 Fe N12 -","- C12 H7 Fe N12 -","- C192 H112 Fe16 N192 -","16","0.5","","Zheng Yan; Mian Li; Hui-Ling Gao; Xiao-Chun Huang; Dan Li","High-spin versus spin-crossover versus low-spin: symmetry intervention in cooperativity in a 3D polymorphic iron(II)-tetrazole system","Chem.Commun.","2012","48","","3960","","10.1039/c2cc18140a","","","0.71073","MoKα","","0.0372","0.0336","","","0.0917","0.094","","","","","","1.092","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7107568","7.798","0.0003","26.3062","0.0014","30.3991","0.0012","90","","90","","90","","6235.9","0.5","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H7 Fe N12 -","- C12 H7 Fe N12 -","- C192 H112 Fe16 N192 -","16","0.5","","Zheng Yan; Mian Li; Hui-Ling Gao; Xiao-Chun Huang; Dan Li","High-spin versus spin-crossover versus low-spin: symmetry intervention in cooperativity in a 3D polymorphic iron(II)-tetrazole system","Chem.Commun.","2012","48","","3960","","10.1039/c2cc18140a","","","0.71073","MoKα","","0.0396","0.0315","","","0.0719","0.0756","","","","","","1.053","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7107663","12.7589","0.0013","22.66","0.03","24.053","0.004","90","","90","","90","","6954","9","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C15 H17 N5 O5 Zn -","- C12 H10 N4 O4 Zn -","- C192 H160 N64 O64 Zn16 -","16","0.5","","Fei Wang; Yan-Xi Tan; Hui Yang; Yao Kang; Jian Zhang","Open diamondoid amino-functionalized MOFs for CO2 capture","Chem.Commun.","2012","48","","4842","","10.1039/c2cc31211e","","","0.71073","MoKα","","0.0433","0.0337","","","0.0889","0.0923","","","","","","1.005","","","","has coordinates","180180","2020-10-21","18:00:00",""
"7107664","12.7743","0.0008","22.1735","0.0015","24.5295","0.0017","90","","90","","90","","6948","0.8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C12.5 H12 N4 O4.5 Zn -","- C12 H10 N4 O4 Zn -","- C192 H160 N64 O64 Zn16 -","16","0.5","","Fei Wang; Yan-Xi Tan; Hui Yang; Yao Kang; Jian Zhang","Open diamondoid amino-functionalized MOFs for CO2 capture","Chem.Commun.","2012","48","","4842","","10.1039/c2cc31211e","","","0.71073","MoKα","","0.0374","0.033","","","0.1002","0.1023","","","","","","1.124","","","","has coordinates","180180","2020-10-21","18:00:00",""
"7107816","18.303","0.004","46.917","0.011","91.25","0.02","90","","90","","90","","78358","3","180","2","180","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C237 H246 Ce4 N44 O60 -","- C237.06 H196.28 Ce4 N44.04 O60.08 -","- C1896.48 H1570.24 Ce32 N352.32 O480.64 -","8","0.25","","Yang Jiao; Jing Zhang; Lejie Zhang; Zhihua Lin; Cheng He; Chun-ying Duan","Metal-organic polyhedra containing 36 and 24 folds of amide groups for selective luminescent recognition of natural disaccharides","Chem.Commun.","2012","48","","6022","","10.1039/c2cc30497j","","","0.71073","MoKα","","0.2156","0.0959","","","0.2232","0.2497","","","","","","1.036","","","","has coordinates,has disorder","180182","2020-10-21","18:00:00",""
"7108031","23.9228","0.001","25.3459","0.001","38.9296","0.0016","90","","90","","90","","23604.8","1.7","100","2","100","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C34 H40 Al3 B5 Cl14 N4 O6 -","- C34 H40 Al3 B5 Cl14 N4 O6 -","- C544 H640 Al48 B80 Cl224 N64 O96 -","16","0.5","","Alessandro Del Grosso; Ewan Clark; Nicholas Montoute; Michael Ingleson","Tricationic analogues of boroxines and polyborate anions","Chem.Commun.","2012","48","","7589","","10.1039/c2cc32605a","","","0.71073","MoKα","","0.0913","0.047","","","0.1002","0.1077","","","","","","0.824","","","","has coordinates","180184","2020-10-21","18:00:00",""
"7108421","16.6727","0.0011","30.982","0.002","33.554","0.002","90","","90","","90","","17332.4","1.9","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C17 H21 Cu N2 O7.5 -","- C17 H16 Cu N2 O5 -","- C544 H512 Cu32 N64 O160 -","32","1","","Qingxiang Yang; Xingqiu Chen; Zhijun Chen; Ying Hao; Yizhi Li; Qingyi Lu; Hegen Zheng","Metal-organic frameworks constructed from flexible V-shaped ligands: adjustment of the topology, interpenetration and porosity via a solvent system","Chem.Commun.","2012","48","","10016","","10.1039/c2cc35340g","","","0.71073","MoKα","","0.0724","0.0618","","","0.1583","0.1667","","","","","","1.061","","","","has coordinates,has disorder","180188","2020-10-21","18:00:00",""
"7108715","34.779","0.004","38.186","0.004","47.98","0.005","90","","90","","90","","63721","12","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C90 Ba10 Br N18 O158 V48 -","- C90 Ba10 Br N18 O158 V48 -","- C720 Ba80 Br8 N144 O1264 V384 -","8","0.25","","Katharina Kastner; Bianka Puscher; Carsten Streb","Self-assembly of a tetrahedral 58-nuclear barium vanadium oxide cluster","Chem.Commun.","2013","49","","140","","10.1039/c2cc36638j","","","0.71073","MoKα","","0.081","0.0592","","","0.1787","0.1938","","","","","","1.091","","","","has coordinates","180191","2020-10-21","18:00:00",""
"7109272","12.0923","0.0012","29.578","0.003","53.934","0.005","90","","90","","90","","19290","3","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C98 H146 N4 P8 -","- C98 H146 N4 P8 -","- C784 H1168 N32 P64 -","8","0.25","","Caleb D. Martin; Cory M. Weinstein; Curtis E. Moore; Arnold L. Rheingold; Guy Bertrand","Exploring the reactivity of white phosphorus with electrophilic carbenes: synthesis of a P4 cage and P8 clusters","Chem.Commun.","2013","49","","4486","","10.1039/c3cc42041h","","","0.71073","MoKα","","0.0756","0.0432","","","0.0934","0.1067","","","","","","1.008","","","","has coordinates","180196","2020-10-21","18:00:00",""
"7109711","15.6139","0.0008","18.3439","0.0011","34.336","0.003","90","","90","","90","","9834.5","1.2","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C12 H19 Co3 N10 O12.5 -","- C12 H16 Co3 N10 O12.5 -","- C192 H256 Co48 N160 O200 -","16","0.5","","Ji-Yong Zou; Wei Shi; Na Xu; Lei-Lei Li; Jin-Kui Tang; Hong-Ling Gao; Jian-Zhong Cui; Peng Cheng","A homospin cobalt(II) topological ferrimagnet","Chem.Commun.","2013","49","","8226","","10.1039/c3cc43642j","","","0.71073","MoKα","","0.0694","0.049","","","0.1473","0.1574","","","","","","1.127","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7109839","23.0051","0.0004","29.8285","0.0006","42.2334","0.0008","90","","90","","90","","28980.9","0.9","200","2","200","2","","","","","","","","10","F d d d :2","-F 2uv 2vw","70","","","","- C112 H136 Cl2 Cu2 Gd0 Mo2 N32 Ni2 O44 Tb2 -","- C112 H96 Cl2 Cu2 Mo2 N32 Ni2 O44 Tb2 -","- C896 H768 Cl16 Cu16 Mo16 N256 Ni16 O352 Tb16 -","8","0.25","","Nathalie Bridonneau; Lise-Marie Chamoreau; Philippe P. Laine; Wolfgang Wernsdorfer; Valerie Marvaud","A new versatile class of hetero-tetra-metallic assemblies: highlighting single-molecule magnet behaviour","Chem.Commun.","2013","49","","9476","","10.1039/c3cc45037f","","","0.71073","MoKα","","0.0607","0.0431","","","0.121","0.1396","","","","","","1.089","","","","has coordinates","180204","2020-10-21","18:00:00",""
"7109840","23.0007","0.0007","29.7883","0.0009","42.1077","0.0012","90","","90","","90","","28850.2","1.5","200","2","200","2","","","","","","","","9","F d d d :2","-F 2uv 2vw","70","","","","- C112 H136 Cl2 Cu2 N32 Ni2 O44 Tb2 W2 -","- C112 H96 Cl2 Cu2 N32 Ni2 O44 Tb2 W2 -","- C896 H768 Cl16 Cu16 N256 Ni16 O352 Tb16 W16 -","8","0.25","","Nathalie Bridonneau; Lise-Marie Chamoreau; Philippe P. Laine; Wolfgang Wernsdorfer; Valerie Marvaud","A new versatile class of hetero-tetra-metallic assemblies: highlighting single-molecule magnet behaviour","Chem.Commun.","2013","49","","9476","","10.1039/c3cc45037f","","","0.71073","MoKα","","0.0549","0.0315","","","0.0846","0.1038","","","","","","0.992","","","","has coordinates","180204","2020-10-21","18:00:00",""
"7109841","22.9246","0.0007","29.8958","0.0009","41.9514","0.0014","90","","90","","90","","28751.4","1.6","200","2","200","2","","","","","","","","9","F d d d :2","-F 2uv 2vw","70","","","","- C112 H144 Cl0 Cu2 Mo2 N34 O46 Ru2 Tb2 -","- C112 H104 Cu2 Mo2 N34 O46 Ru2 Tb2 -","- C896 H832 Cu16 Mo16 N272 O368 Ru16 Tb16 -","8","0.25","","Nathalie Bridonneau; Lise-Marie Chamoreau; Philippe P. Laine; Wolfgang Wernsdorfer; Valerie Marvaud","A new versatile class of hetero-tetra-metallic assemblies: highlighting single-molecule magnet behaviour","Chem.Commun.","2013","49","","9476","","10.1039/c3cc45037f","","","0.71073","MoKα","","0.0618","0.0383","","","0.0934","0.1061","","","","","","1.032","","","","has coordinates","180204","2020-10-21","18:00:00",""
"7109842","22.8937","0.0007","29.8563","0.001","41.8842","0.0013","90","","90","","90","","28628.7","1.6","200","1","200","1","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C112 H140 Cu2 N34 O40 Os2 Tb2 W2 -","- C112 H104 Cu2 N34 O40 Os2 Tb2 W2 -","- C896 H832 Cu16 N272 O320 Os16 Tb16 W16 -","8","0.25","","Nathalie Bridonneau; Lise-Marie Chamoreau; Philippe P. Laine; Wolfgang Wernsdorfer; Valerie Marvaud","A new versatile class of hetero-tetra-metallic assemblies: highlighting single-molecule magnet behaviour","Chem.Commun.","2013","49","","9476","","10.1039/c3cc45037f","","","0.71073","MoKα","","0.0637","0.0366","","","0.1012","0.1226","","","","","","1.059","","","","has coordinates,has disorder","180204","2020-10-21","18:00:00",""
"7111732","15.107","0.0004","27.386","0.0007","29.038","0.0007","90","","90","","90","","12013.6","0.5","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C54 H47 Cl4 Eu N8 O9 -","- C52 H41 Cl4 Eu N8 O8 -","- C416 H328 Cl32 Eu8 N64 O64 -","8","0.25","","Burrows, Andrew D.; Frost, Christopher G.; Mahon, Mary F.; Raithby, Paul R.; Renouf, Catherine L.; Richardson, Christopher; Stevenson, Anna J.","Dipyridyl β-diketonate complexes: versatile polydentate metalloligands for metal‒organic frameworks and hydrogen-bonded networks","Chemical Communications","2010","46","28","5067","5069","10.1039/c0cc00646g","","","0.71073","MoKα","","0.0602","0.0502","","","0.1079","0.1123","","","","","","1.192","","","","has coordinates","180231","2020-10-21","18:00:00",""
"7111813","14.6651","0.0015","25.318","0.003","46.706","0.005","90","","90","","90","","17342","3","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C66 H58 Cl6 F18 N12 -","- C66 H58 Cl6 F18 N12 -","- C528 H464 Cl48 F144 N96 -","8","0.25","","Joao M. M. Rodrigues; Andreia S. F. Farinha; Paulino V. Muteto; Sandra M. Woranovicz-Barreira; Filipe A. Almeida Paz; Maria G. P. M. S. Neves; Jose A. S. Cavaleiro; Augusto C. Tome; M. Teresa S. R. Gomes; Jonathan L. Sessler; Joao P. C. Tome","New porphyrin derivatives for phosphate anion sensing in both organic and aqueous media","Chem.Commun.","2014","50","","1359","","10.1039/c3cc47504b","","","0.71073","MoKα","","0.1629","0.0887","","","0.2558","0.2886","","","","","","1.04","","","","has coordinates","180232","2020-10-21","18:00:00",""
"7113518","17.156","0.002","21.443","0.003","41.221","0.002","90","","90","","90","","15164","3","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C86 H74 Cu2 N10 O8 S4 -","- C86 H68 Cu2 N10 O8 S4 -","- C688 H544 Cu16 N80 O64 S32 -","8","0.25","","V�zquez, Miguel; Taglietti, Angelo; Gatteschi, Dante; Sorace, Lorenzo; Sangregorio, Claudio; Gonz�lez, Ana M.; Maneiro, Marcelino; Pedrido, Rosa M.; Bermejo, Manuel R.","A 3D network of helicates fully assembled by ?-stacking interactions","Chemical Communications","2003","","15","1840","","10.1039/b303549b","","","1.54178","CuKα","","0.1109","0.0503","","","0.1367","0.168","","","","","","0.995","","","","has coordinates","180249","2020-10-21","18:00:00",""
"7114893","16.941","0.005","20.576","0.003","24.918","0.004","90","","90","","90","","8686","3","200","2","200","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C48 H58 N4 Zn2 -","- C48 H58 N4 Zn2 -","- C384 H464 N32 Zn16 -","8","0.25","","Hao, Haijun; Cui, Chunming; Roesky, Herbert W.; Bai, Guangcai; Schmidt, Hans-Georg; Noltemeyer, Mathias","Syntheses and structures of the first examples of zinc compounds with bridging fluorine and hydrogen atoms","Chemical Communications","2001","","12","1118","","10.1039/b102275j","","","0.71073","MoKα","","0.0366","0.0309","","","0.0787","0.0831","","","","","","1.102","","","","has coordinates","190011","2020-10-21","18:00:00",""
"7115620","22.3697","0.0012","23.8656","0.0014","59.021","0.004","90","","90","","90","","31509","3","103","2","103","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C144 H122 O8 -","- C144 H122 O8 -","- C1152 H976 O64 -","8","0.25","","Akinobu Matsumoto; Mitsuharu Suzuki; Daiki Kuzuhara; Junpei Yuasa; Tsuyoshi Kawai; Naoki Aratani","A kinetically protected pyrene: molecular design, bright blue emission in the crystalline state and aromaticity relocation in its dicationic species","Chem.Commun.","2014","50","","10956","","10.1039/C4cc03645J","","","0.71075","MoKα","","0.2317","0.1258","","","0.3171","0.3914","","","","","","1.129","","","","has coordinates,has disorder","180270","2020-10-21","18:00:00",""
"7118113","7.9878","0.0001","33.9352","0.0006","39.1992","0.0007","90","","90","","90","","10625.6","0.3","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C48 H32 Br8 Cu10 N4 O9 -","- C48 H32 Br8 Cu10 N4 O9 -","- C384 H256 Br64 Cu80 N32 O72 -","8","0.25","","Wei-Hui Fang; Lei Zhang; Jian Zhang; Guo-Yu Yang","A highly stable face-extended diamondoid cluster-organic framework incorporating infinite inorganic guests","Chem.Commun.","2015","51","","17174","","10.1039/C5cc06931A","","","1.54178","CuKα","","0.0616","0.0606","","","0.1881","0.1884","","","","","","1.166","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7122288","13.1003","0.001","21.3132","0.001","21.3804","0.001","90","","90","","90","","5969.6","0.6","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C20 H32 As4 F12 W2 -","- C20 H32 As4 F12 W2 -","- C160 H256 As32 F96 W16 -","8","0.25","","Levason, William; Monzittu, Francesco M.; Reid, Gillian; Zhang, Wenjian","Neutral and cationic tungsten(vi) fluoride complexes with tertiary phosphine and arsine coordination.","Chemical communications (Cambridge, England)","2018","54","83","11681","11684","10.1039/c8cc05598j","","x-ray","0.71073","MoKα","","0.0539","0.0375","","","0.1036","0.1115","","","","","","1.143","","","","has coordinates","228093","2020-10-21","18:00:00",""
"7124537","16.995","0.002","44.439","0.006","54.864","0.008","90","","90","","90","","41436","10","175","2","175","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C18 H20 Cu2 I2 N2 O6 Sb -","- C18 H20 Cu2 I2 N2 O6 Sb -","- C576 H640 Cu64 I64 N64 O192 Sb32 -","32","1","","Lin, Li-Dan; Li, Zhong; Liu, Jin-Hua; Sun, Yan-Qiong; Li, Xin-Xiong; Zheng, Shou-Tian","New type composite MOFs based on high-valent Sb(V)-based units and cuprous-halide clusters","Chemical Communications","2019","","","","","10.1039/C9CC08443F","","","0.71073","MoKα","","0.1193","0.0983","","","0.2788","0.2976","","","","","","0.995","","","","has coordinates,has disorder","231184","2020-10-21","18:00:00",""
"7125382","8.6064","0.0012","28.201","0.004","29.216","0.004","90","","90","","90","","7091","1.7","100","","100","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C14 H16 Cl2 N4 Zn -","- C14 H16 Cl2 N4 Zn -","- C224 H256 Cl32 N64 Zn16 -","16","0.5","","Sakaguchi, Yuto; Call, Arnau; Cibian, Mihaela; Yamauchi, Kosei; Sakai, Ken","An earth-abundant system for light-driven CO<sub>2</sub> reduction to CO using a pyridinophane iron catalyst.","Chemical communications (Cambridge, England)","2019","55","59","8552","8555","10.1039/c9cc04191e","","x-ray","0.71073","MoKα","","0.0397","0.0299","","","0.0784","0.0842","","","","","","1.07","","","","has coordinates","237840","2020-10-21","18:00:00",""
"7125483","16.646","0.006","18.189","0.006","14.887","0.006","90","","90","","90","","4507","3","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C12 H20 B2 F8 N4 Ni S4 -","- C12 H20 B2 F8 N4 Ni S4 -","- C96 H160 B16 F64 N32 Ni8 S32 -","8","0.25","","Bigoli, F.; Chen, C. T.; Wu, W. C.; Deplano, P.; Mercuri, M. L.; Pellinghelli, M. A.; Pilia, L.; Pintus, G.; Serpe, A.; Trogu, E. F.","[Ni(R2pipdt)2](BF4)2 (R2pipdt = 1,4-disubstituted-piperazine-3,2-dithione) as useful precursors of mixed-ligand dithiolenes of interest for non-linear optics.","Chemical communications (Cambridge, England)","2001","","21","2246","2247","10.1039/b106064n","","","0.71073","MoKα","","0.1554","0.075","","","0.2019","0.2316","","","","","","0.766","","","","has coordinates","243952","2020-10-21","18:00:00",""
"7125727","20.677","0.004","21.726","0.004","36.877","0.007","90","","90","","90","","16566","5","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","Spiro(TFSI)2","2,2',7,7'-Tetrakis[N,N-di(4-methoxyphenyl)amino]-9,9'-spirobifluorene bis(trifluoromethanesulfonyl)imide","","- C85 H68 F12 N6 O16 S4 -","- C85 H68 F12 N6 O16 S4 -","- C680 H544 F96 N48 O128 S32 -","8","0.25","","Zhang, Wei; Wang, Linqin; Guo, Yu; Zhang, Biaobiao; Leandri, Valentina; Xu, Bo; Li, Zhuofeng; Gardner, James M.; Sun, Licheng; Kloo, Lars","Single crystal structure and opto-electronic properties of oxidized Spiro-OMeTAD.","Chemical communications (Cambridge, England)","2020","56","10","1589","1592","10.1039/c9cc09270f","","","0.71073","MoKα","","0.0736","0.0697","","","0.2277","0.2323","","","","","","1.915","","","","has coordinates","248803","2020-10-21","18:00:00",""
"7126368","12.36","0.004","29.522","0.009","35.0152","0.001","90","","90","","90","","12777","6","123","","123","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C50 H60 Au6 F12 N8 O2 P2 S4 -","- C50 H60 Au6 F12 N8 O2 P2 S4 -","- C400 H480 Au48 F96 N64 O16 P16 S32 -","8","0.25","","Salorinne, Kirsi; Man, Renee W. Y.; Lummis, Paul A.; Hazer, Maryam Sabooni Asre; Malola, Sami; Yim, Jacky C.-H.; Veinot, Alex J.; Zhou, Wenxia; Häkkinen, Hannu; Nambo, Masakazu; Crudden, Cathleen M.","Synthesis and properties of an Au<sub>6</sub> cluster supported by a mixed N-heterocyclic carbene-thiolate ligand.","Chemical communications (Cambridge, England)","2020","56","45","6102","6105","10.1039/d0cc01482f","","","0.71075","MoKα","","0.0227","0.0178","","","0.0413","0.042","","","","","","0.992","","","","has coordinates,has disorder","253825","2020-10-21","18:00:00",""
"7126643","13.1949","0.0004","31.055","0.0006","40.4621","0.0007","90","","90","","90","","16580.1","0.7","150","0.1","150","0.1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C34.5 H28 Cl2 Fe P2 Rh -","- C34.5 H28 Cl2 Fe P2 Rh -","- C552 H448 Cl32 Fe16 P32 Rh16 -","16","0.5","","Barnett, Harrison J.; Hill, Anthony F.","Halogenation of A-frame μ-carbido complexes: a diamagnetic rhodium(ii) carbido complex.","Chemical communications (Cambridge, England)","2020","56","56","7738","7740","10.1039/d0cc02349c","","x-ray","1.54184","CuKα","","0.0486","0.0463","","","0.136","0.139","","","","","","1.084","","","","has coordinates","254880","2020-10-21","18:00:00",""
"7127162","17.6218","0.0016","36.0338","0.0019","50.356","0.002","90","","90","","90","","31975","4","123","10","123","10","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","[Mn(NCP2)2]","catena-((4-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)biphenyl-4-carboxylato)-manganese)","","- C52 H30 Mn N8 O4 -","- C52 H30 Mn N8 O4 -","- C832 H480 Mn16 N128 O64 -","16","0.5","","Setter, Caitlin J.; Price, Michael B.; Conte, Luke; Schmitt, Wolfgang; Batten, Stuart R.; Richardson, Christopher; Hill, Matthew R.; Babarao, Ravichandar; Macreadie, Lauren K.","Mixed donor, phenanthroline photoactive MOFs with favourable CO<sub>2</sub> selectivity.","Chemical communications (Cambridge, England)","2020","56","87","13377","13380","10.1039/d0cc05715k","","","1.54178","CuKα","","0.1638","0.0958","","","0.238","0.2762","","","","","","0.925","","","","has coordinates","260707","2021-01-07","04:59:00",""
"7127842","20.7362","0.0005","25.0136","0.0005","38.8351","0.0013","90","","90","","90","","20143.3","0.9","297.27","0.1","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C52 H84 Al10 F0.12 O50 -","- C52 H84 Al10 F2 O48 -","- C416 H672 Al80 F16 O384 -","8","0.25","","Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian","Aluminium nanorings: configuration deformation and structural transformation.","Chemical communications (Cambridge, England)","2021","57","16","2085","2088","10.1039/d0cc07513b","","","1.3405","GaKα","","0.0384","0.0358","","","0.1097","0.1121","","","","","","1.05","","","","has coordinates","262482","2021-03-05","01:18:47",""
"7129186","31.5215","0.0005","60.4942","0.0004","117.8414","0.001","90","","90","","90","","224708","4","100","0.7","100","0.7","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C864 H666 Al30 O342 Zn60 -","- C864 H666 Al30 O342 Zn60 -","- C6912 H5328 Al240 O2736 Zn480 -","8","0.25","","Wang, San-Tai; Liu, Chen-Hui; Zheng, Chan; Li, De-Jing; Fang, Wei-Hui; Zhang, Jian","Heterometallic Al6Zn12 nano-plate with π-conjugated ligand: synthesis and nonlinear absorption properties","Chemical Communications","2021","","","","","10.1039/D1CC05919J","","x-ray","1.3405","GaKα","","0.0896","0.0671","","","0.1791","0.1941","","","","","","1.031","","","","has coordinates","270268","2021-11-03","22:57:23",""
"7129396","12.0221","0.0012","30.358","0.003","32.27","0.003","90","","90","","90","","11777","2","150","2","150","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C66 H74 B4 Fe2 N2 -","- C66 H74 B4 Fe2 N2 -","- C528 H592 B32 Fe16 N16 -","8","0.25","","Brown, W. Kice; Klausmeyer, Kevin; Lindley, Brian M.","Unlocking Metal Coordination of Diborylamides through Ring Constraints","Chemical Communications","2022","","","","","10.1039/D1CC06458D","","","0.71073","MoKα","","0.0464","0.0418","","","0.1119","0.1158","","","","","","1.07","","","","has coordinates","271480","2021-12-16","22:56:03",""
"7130728","8.7425","0.0002","20.7426","0.0006","34.3362","0.0007","90","","90","","90","","6226.6","0.3","298","","298","","101.325","","101.325","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0338","0.033","","0.0695","0.0693","0.0695","","","","","","42.3716","","","","has coordinates","277957","2022-09-18","21:55:50",""
"7130729","8.7465","0.0004","20.7246","0.001","34.3207","0.0014","90","","90","","90","","6221.2","0.5","298","","298","","20000","","20000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.2 H9 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0366","0.0323","","0.0885","0.0864","0.0885","","","","","","1.0115","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130730","8.7455","0.0004","20.7289","0.001","34.3277","0.0014","90","","90","","90","","6223.1","0.5","298","","298","","10000","","10000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.6 H9.9 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0374","0.0329","","0.0904","0.0877","0.0904","","","","","","1.0043","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130731","8.7541","0.0004","20.7081","0.0012","34.274","0.0017","90","","90","","90","","6213.2","0.6","298","","298","","70000","","70000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C14 H10.9 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0448","0.0378","","0.1039","0.1001","0.1039","","","","","","0.9879","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130732","8.7486","0.0004","20.7218","0.001","34.3093","0.0014","90","","90","","90","","6219.8","0.5","298","","298","","30000","","30000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.7 H10.2 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0384","0.0332","","0.0933","0.0905","0.0933","","","","","","1.0053","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130733","8.7564","0.0005","20.7042","0.0013","34.2663","0.0019","90","","90","","90","","6212.3","0.6","298","","298","","80000","","80000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C14 H10.8 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0454","0.0372","","0.1035","0.0983","0.1035","","","","","","0.9956","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130734","8.7518","0.0005","20.7136","0.0012","34.2831","0.0017","90","","90","","90","","6214.9","0.6","298","","298","","60000","","60000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.8 H10.3 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.043","0.036","","0.0982","0.0949","0.0982","","","","","","0.9972","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130735","8.7648","0.0006","20.7017","0.0014","34.221","0.002","90","","90","","90","","6209.3","0.7","298","","298","","120000","","120000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.8 H10.4 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0547","0.0438","","0.1354","0.1276","0.1354","","","","","","1.0137","","","","has coordinates","287939","2023-12-01","16:52:17",""
"7130736","8.7606","0.0005","20.7017","0.0013","34.245","0.002","90","","90","","90","","6210.6","0.6","298","","298","","100000","","100000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.9 H10.5 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0508","0.0403","","0.1149","0.1085","0.1149","","","","","","1.001","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130737","8.7488","0.0004","20.7196","0.0011","34.2997","0.0016","90","","90","","90","","6217.6","0.5","298","","298","","40000","","40000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.5 H9.5 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0424","0.0354","","0.0964","0.0932","0.0964","","","","","","0.994","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130738","8.7483","0.0003","20.738","0.0004","34.3334","0.0008","90","","90","","90","","6228.8","0.3","298","","298","","5000","","5000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C14.2 H11.2 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.04","0.0357","","0.1015","0.0987","0.1015","","","","","","0.9944","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130739","8.7504","0.0002","20.7378","0.0004","34.3314","0.0008","90","","90","","90","","6229.9","0.2","298","","298","","20000","","20000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C14.1 H11 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0406","0.0364","","0.1021","0.0993","0.1021","","","","","","0.999","","","","has coordinates","287939","2023-12-01","16:52:17",""
"7130740","8.7508","0.0005","20.716","0.0011","34.2933","0.0016","90","","90","","90","","6216.7","0.6","298","","298","","50000","","50000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C13.8 H10.3 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0419","0.0352","","0.0965","0.0932","0.0965","","","","","","0.9884","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130741","8.7547","0.0002","20.7361","0.0004","34.3257","0.0008","90","","90","","90","","6231.4","0.2","298","","298","","40000","","40000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C14.2 H11.3 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0393","0.0355","","0.1015","0.0991","0.1015","","","","","","0.9956","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130742","8.7579","0.0003","20.737","0.0005","34.3224","0.0009","90","","90","","90","","6233.4","0.3","298","","298","","60000","","60000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C14.4 H11.7 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0413","0.037","","0.1078","0.1049","0.1078","","","","","","0.9902","","","","has coordinates","287939","2023-12-01","16:52:17",""
"7130743","8.7611","0.0003","20.7372","0.0005","34.314","0.001","90","","90","","90","","6234.2","0.3","298","","298","","90000","","90000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C14.5 H11.9 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0419","0.0351","","0.0988","0.0952","0.0988","","","","","","0.9722","","","","has coordinates","287939","2023-12-01","16:52:17",""
"7130744","8.7577","0.0005","20.7045","0.0012","34.2603","0.0019","90","","90","","90","","6212.2","0.6","298","","298","","90000","","90000","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","","","- C14 H10.9 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0458","0.0379","","0.106","0.1009","0.106","","","","","","0.9874","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7130745","8.7604","0.0003","20.7351","0.0005","34.3174","0.0011","90","","90","","90","","6233.7","0.3","298","","298","","","","80000","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C14.6 H12.4 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McMonagle, Charles J.; Turner, Gemma; Jones, Isabelle; Allan, David Robert; Warren, Mark R.; Kamenev, K.; Parsons, Simon; Wright, Paul; Moggach, Stephen A.","Pressure and Guest-Mediated Pore Shape Modification in a Small Pore MOF to 1200 bar","Chemical Communications","2022","","","","","10.1039/D2CC04649K","","x-ray","0.6889","synchrotron","","0.0448","0.0378","","0.1074","0.1033","0.1074","","","","","","0.972","","","","has coordinates","277957","2022-09-18","21:55:55",""
"7150598","13.9453","0.0004","25.7283","0.0005","31.5668","0.0007","90","","90","","90","","11325.8","0.5","260","1","260","1","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C19 H17.5 N2.5 -","- C19.66 H16 N2 -","- C629.12 H512 N64 -","32","1","","Rahanyan, Nelli; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.","Diels‒Alder reactions of 3,6-disubstituted 1,2,4,5-tetrazines. Synthesis and X-ray crystal structures of diazafluoranthene derivatives","Organic & Biomolecular Chemistry","2009","7","10","2082","2092","10.1039/b820551e","","","0.71073","MoKα","","0.0886","0.0559","","","0.1472","0.1748","","","","","","1.014","","","","has coordinates","180291","2020-10-21","18:00:00",""
"7158448","10.4753","0.0014","12.8737","0.0018","24.51","0.003","90","","90","","90","","3305.3","0.8","273.15","","273.15","","","","","","","","","1","F d d d :2","-F 2uv 2vw","70","","","","- S8 -","- S8 -","- S128 -","16","0.5","","Chen, Wei; Zhou, Hui; Ren, Bai-Hao; Ren, Wei-Min; Lu, Xiao-Bing","COS-triggered oxygen/sulfur exchange of isatins: chemoselective synthesis of functionalized isoindigos and spirothiopyrans <i>via</i> self-condensation and the thio-Diels-Alder reaction.","Organic & biomolecular chemistry","2022","20","3","678","685","10.1039/d1ob02157e","","","0.71073","MoKα","","0.0232","0.02","","","0.0484","0.0499","","","","","","1.063","","","","has coordinates","272780","2022-02-04","20:03:30",""
"7200149","9.625","0.005","15.381","0.011","27.53","0.015","90","","90","","90","","4076","4","294","2","294","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C5 H12 Nd O10 -","- C5 H12 Nd O10 -","- C80 H192 Nd16 O160 -","16","0.5","","Zhu, Ping; Gu, Wen; Liu, Mei-Ling; Song, Hai-Bin; Liu, Xin; Gao, Yue-Qiang; Duan, Hong-Yue; Yan, Shi-Ping; Liao, Dai-Zheng","A family of 3D lanthanide oxalatosuccinate with rare structures: 3D host framework incorporating a 3D alkali metal guest lattice","CrystEngComm","2009","11","2","351","","10.1039/b804956d","","","0.71073","MoKα","","0.0226","0.0201","","","0.0476","0.049","","","","","","1.083","","","","has coordinates","180332","2020-10-21","18:00:00",""
"7201020","10.6151","0.0011","20.157","0.002","49.67","0.005","90","","90","","90","","10627.8","1.9","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C19 H24 Au2 Mn N7 O3.5 -","- C19 H24 Au2 Mn N7 O3.5 -","- C304 H384 Au32 Mn16 N112 O56 -","16","0.5","","Zhang, Daopeng; Wang, Hailong; Tian, Laijin; Jiang, Jianzhuang; Ni, Zhong-Hai","Rational design of cyanide-bridged heterometallic M(I)‒Mn(II) (M = Ag, Au) one-dimensional chain complexes: synthesis, crystal structures and magnetic properties","CrystEngComm","2009","11","11","2447","","10.1039/b903174j","","","0.71073","MoKα","","0.0463","0.0341","","","0.0915","0.0995","","","","","","1.014","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7201021","10.6783","0.0007","20.0234","0.0016","50.001","0.003","90","","90","","90","","10691","1.3","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C19 H24 Ag2 Mn N7 O3.5 -","- C19 H24 Ag2 Mn N7 O3.5 -","- C304 H384 Ag32 Mn16 N112 O56 -","16","0.5","","Zhang, Daopeng; Wang, Hailong; Tian, Laijin; Jiang, Jianzhuang; Ni, Zhong-Hai","Rational design of cyanide-bridged heterometallic M(I)‒Mn(II) (M = Ag, Au) one-dimensional chain complexes: synthesis, crystal structures and magnetic properties","CrystEngComm","2009","11","11","2447","","10.1039/b903174j","","","0.71073","MoKα","","0.0558","0.046","","","0.1587","0.1728","","","","","","1.049","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7201084","9.6673","0.0003","15.4344","0.0003","27.2399","0.0003","90","","90","","90","","4064.44","0.16","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C5 H10 Gd O10 -","- C5 H6 Gd O10 -","- C80 H96 Gd16 O160 -","16","0.5","","Cañadillas-Delgado, Laura; Fabelo, Oscar; Cano, Joan; Pasán, Jorge; Delgado, Fernando S.; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Dinuclear and two- and three-dimensional gadolinium(III) complexes with mono- and dicarboxylate ligands: synthesis, structure and magnetic properties","CrystEngComm","2009","11","10","2131","","10.1039/b904764f","","x-ray","0.71073","MoKα","","0.0363","0.0238","","","0.0354","0.0375","","","","","","1.143","","","","has coordinates","180341","2020-10-21","18:00:00",""
"7201942","13.979","0.003","19.7","0.005","36.094","0.009","90","","90","","90","","9940","4","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H24 Co N2 O6 -","- C27 H22 Co N2 O6 -","- C432 H352 Co16 N32 O96 -","16","0.5","","Hu, Yawei; Li, Guanghua; Liu, Xiaomin; Hu, Bin; Bi, Minghui; Gao, Lu; Shi, Zhan; Feng, Shouhua","Hydrothermal synthesis and characterization of metal‒organic networks with helical units in a mixed ligand system","CrystEngComm","2008","10","7","888","","10.1039/b800255j","","","0.71073","MoKα","","0.1499","0.0992","","","0.2565","0.3002","","","","","","1.035","","","","has coordinates","180350","2020-10-21","18:00:00",""
"7202267","19.511","0.006","13.973","0.005","36.231","0.016","90","","90","","90","","9878","6","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H23 Cu N2 O6 -","- C27 H23 Cu N2 O6 -","- C432 H368 Cu16 N32 O96 -","16","0.5","","Liu, Jian-Qiang; Wang, Yao-Yu; Ma, Lu-Fang; Wen, Gui-Lin; Shi, Qi-Zhen; Batten, Stuart R.; Proserpio, Davide M.","Generation of a 4-crossing [2]-catenane motif by the 2D→2D parallel interpenetration of pairs of (4,4) sheets","CrystEngComm","2008","10","9","1123","","10.1039/b808540b","","","0.71073","MoKα","","0.1989","0.0643","","","0.1413","0.1657","","","","","","0.849","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202268","13.993","0.003","19.661","0.004","36.141","0.008","90","","90","","90","","9943","4","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H22 Co N2 O6 -","- C27 H22 Co N2 O6 -","- C432 H352 Co16 N32 O96 -","16","0.5","","Liu, Jian-Qiang; Wang, Yao-Yu; Ma, Lu-Fang; Wen, Gui-Lin; Shi, Qi-Zhen; Batten, Stuart R.; Proserpio, Davide M.","Generation of a 4-crossing [2]-catenane motif by the 2D→2D parallel interpenetration of pairs of (4,4) sheets","CrystEngComm","2008","10","9","1123","","10.1039/b808540b","","","0.71073","MoKα","","0.1744","0.086","","","0.2335","0.2739","","","","","","0.812","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202269","13.963","0.008","19.593","0.011","36.03","0.02","90","","90","","90","","9857","10","293","2","298","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C54 H48 N4 Ni2 O12 -","- C54 H48 N4 Ni2 O12 -","- C432 H384 N32 Ni16 O96 -","8","0.25","","Liu, Jian-Qiang; Wang, Yao-Yu; Ma, Lu-Fang; Wen, Gui-Lin; Shi, Qi-Zhen; Batten, Stuart R.; Proserpio, Davide M.","Generation of a 4-crossing [2]-catenane motif by the 2D→2D parallel interpenetration of pairs of (4,4) sheets","CrystEngComm","2008","10","9","1123","","10.1039/b808540b","","","0.71073","MoKα","","0.2175","0.0947","","","0.2449","0.271","","","","","","1.06","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202290","10.7216","0.0005","31.7838","0.0013","59.5","0.002","90","","90","","90","","20276","1.4","150","2","150","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C30 H46 N13 O16 Ru -","- C30 H46 N13 O16 Ru -","- C480 H736 N208 O256 Ru16 -","16","0.5","","Cui, Ying; Cao, Man-Li; Yang, Li-Fei; Niu, Yan-Li; Ye, Bao-Hui","Water nanotubes confined to nanochannels of a (10,3)-b net constructed by binary building blocks via the R22(9) synthon","CrystEngComm","2008","10","10","1288","","10.1039/b809511f","","","0.71073","MoKα","","0.1229","0.0754","","","0.218","0.2368","","","","","","1.024","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202486","21.5093","0.0005","29.6734","0.0008","36.0736","0.0009","90","","90","","90","","23024.1","1","290","2","290","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0573","0.0363","","","0.0979","0.1181","","","","","","1.055","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202487","21.4775","0.0005","29.6112","0.0007","36.0527","0.0009","90","","90","","90","","22928.6","1","270","2","270","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0527","0.0344","","","0.0924","0.1104","","","","","","1.067","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202488","21.4468","0.0005","29.5529","0.0007","36.0359","0.0009","90","","90","","90","","22840.1","0.9","250","2","250","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0492","0.0327","","","0.0878","0.1045","","","","","","1.076","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202489","21.4191","0.0005","29.4937","0.0007","36.0191","0.0009","90","","90","","90","","22754.3","0.9","230","2","230","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0456","0.0318","","","0.0848","0.0996","","","","","","1.075","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202490","21.3887","0.0006","29.4302","0.0008","35.989","0.001","90","","90","","90","","22654.1","1.1","210","2","210","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0418","0.0302","","","0.0809","0.0938","","","","","","1.067","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202491","21.3664","0.0007","29.3735","0.0009","35.975","0.0012","90","","90","","90","","22578.1","1.3","190","2","190","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0396","0.0296","","","0.0787","0.0902","","","","","","1.077","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202492","21.3434","0.0006","29.3178","0.0009","35.9441","0.0011","90","","90","","90","","22491.7","1.2","170","2","170","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0379","0.0292","","","0.073","0.0786","","","","","","1.074","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202860","13.931","0.002","21.777","0.002","35.14","0.006","90","","90","","90","","10661","3","294","2","294","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H28 Co N3 O7 -","- C27 H28 Co N3 O7 -","- C432 H448 Co16 N48 O112 -","16","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.7107","MoKα","","0.0764","0.0721","","","0.137","0.1386","","","","","","1.307","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202864","13.8794","0.0018","21.611","0.004","35.005","0.005","90","","90","","90","","10500","3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H28 N3 Ni O7 -","- C27 H28 N3 Ni O7 -","- C432 H448 N48 Ni16 O112 -","16","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.0809","0.0622","","","0.1363","0.1447","","","","","","1.169","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202996","7.9565","0.0011","13.906","0.002","22.415","0.004","90","","90","","90","","2480.1","0.7","113","","113","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C H5 F7 N Yb2 -","- C H5 F7 N Yb2 -","- C16 H80 F112 N16 Yb32 -","16","0.5","","Jayasundera, Anil C. A.; Finch, Adrian A.; Townsend, P. D.; Lightfoot, Philip","Hydrothermal synthesis and luminescent properties of a new family of organically templated lanthanide fluorides","Journal of Materials Chemistry","2007","17","39","4178","","10.1039/b707993a","","","0.71073","MoKα","","0.0246","0.0194","","","0.0435","0.0458","","","","","","1.042","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7203161","21.932","0.002","25.059","0.002","40.88","0.004","90","","90","","90","","22467","3","120","2","120","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","tetrakis(9,9-dihexyl-2-(pyridin-2-yl)fluorene-C^2^,N')-bis-(μ- chloro)diiridium, bis(dichloromethane) hydrate","","- C122 H150 Cl6 Ir2 N4 O -","- C122 H148 Cl6 Ir2 N4 O -","- C976 H1184 Cl48 Ir16 N32 O8 -","8","0.25","","Bettington, Sylvia; Tavasli, Mustafa; Bryce, Martin R.; Batsanov, Andrei S.; Thompson, Amber L.; Al Attar, Hameed A.; Dias, Fernando B.; Monkman, Andrew P.","Bridged diiridium complexes for electrophosphorescent OLEDs: synthesis, X-ray crystal structures, photophysics, and devices","Journal of Materials Chemistry","2006","16","11","1046","","10.1039/b515258e","","","0.71073","MoKα","","0.119","0.0807","","","0.2002","0.2335","","","","","","1.272","","","","has coordinates,has disorder","180362","2020-10-21","18:00:00",""
"7204217","9.203","0.001","15.776","0.002","31.587","0.004","90","","90","","90","","4586","1","293","","293","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Bis-tetramethylammonium-tri-zinc-tetra-hydrogenphosphate","","- C8 H28 N2 O16 P4 Zn3 -","- C8 H28 N2 O16 P4 Zn3 -","- C64 H224 N16 O128 P32 Zn24 -","8","0.25","","Wiebcke, Michael","[Zn3(HPO4)4](NMe4)2: a zincophosphate containing interruptions of isolated hydrogen-bonding [H‒O(P)]4 groupings within a novel three-dimensional four-connected framework","Journal of Materials Chemistry","2002","12","3","421","","10.1039/b106274n","","","0.71073","MoKα","","0.0939","0.0368","","","0.0729","0.0868","","","","","","1.02","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7206630","13.1073","0.0009","17.5935","0.0013","25.4796","0.0019","90","","90","","90","","5875.7","0.7","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C16 H28 Cl2 Cu N12 O10 -","- C16 H28 Cl2 Cu N12 O9.988 -","- C128 H224 Cl16 Cu8 N96 O79.904 -","8","0.25","","Li, Xia; Gu, Ya-Kun; Deng, Xue-Bin; Zhao, Kai; Jin, Lin-Pei","Effect of anions on architectures of transition metal complexes with 1,4-bis(1,2,4-triazol-1-yl)butane","CrystEngComm","2011","13","22","6665","","10.1039/c1ce05491k","","","0.71073","MoKα","","0.0448","0.037","","","0.1059","0.1108","","","","","","1.111","","","","has coordinates,has disorder","180397","2020-10-21","18:00:00",""
"7206663","19.2774","0.0008","20.9886","0.0007","43.284","0.0016","90","","90","","90","","17513","1.1","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C18.5 H19.5 N2.5 O7.5 S Zn -","- C17 H12 N2 O5 S Zn -","- C544 H384 N64 O160 S32 Zn32 -","32","1","","Bu, Yang; Jiang, Feilong; Zhang, Shuquan; Ma, Jie; Li, Xingjun; Hong, Maochun","Topological variability of Zn(ii) and Co(ii) 3D coordination polymers obtained through solvothermal in situ disulfide cleavage","CrystEngComm","2011","13","21","6323","","10.1039/c1ce05592e","","","0.71073","MoKα","","0.0513","0.046","","","0.1401","0.1466","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7206780","12.869","0.005","23.643","0.01","24.9","0.011","90","","90","","90","","7576","5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C12 H10 Cd N4 O4 -","- C12 H10 Cd N4 O4 -","- C192 H160 Cd16 N64 O64 -","16","0.5","","Pachfule, Pradip; Chen, Yifei; Jiang, Jianwen; Banerjee, Rahul","Experimental and computational approach of understanding the gas adsorption in amino functionalized interpenetrated metal organic frameworks (MOFs)","Journal of Materials Chemistry","2011","21","44","17737","","10.1039/c1jm13762j","","","0.71073","MoKα","","0.0682","0.0653","","","0.1824","0.1861","","","","","","1.165","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206781","12.819","0.002","23.058","0.004","23.654","0.004","90","","90","","90","","6992","2","200","2","200","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C12 H10 Co N4 O4 -","- C12 H10 Co N4 O4 -","- C192 H160 Co16 N64 O64 -","16","0.5","","Pachfule, Pradip; Chen, Yifei; Jiang, Jianwen; Banerjee, Rahul","Experimental and computational approach of understanding the gas adsorption in amino functionalized interpenetrated metal organic frameworks (MOFs)","Journal of Materials Chemistry","2011","21","44","17737","","10.1039/c1jm13762j","","","0.71073","MoKα","","0.0437","0.0335","","","0.1087","0.1108","","","","","","1.11","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206895","12.9833","0.0007","25.7855","0.0014","30.5266","0.0017","90","","90","","90","","10219.7","1","120","2","120","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C25 H28 Co N4 O6 -","- C25 H24 Co N4 O6 -","- C400 H384 Co16 N64 O96 -","16","0.5","","Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju","Construction of helical networks by using multiple V-shaped mixed ligand systems","CrystEngComm","2012","14","2","561","","10.1039/c1ce05380a","","","0.71073","MoKα","","0.0854","0.0529","","","0.1387","0.1591","","","","","","1.029","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206896","12.96","0.001","25.619","0.002","30.85","0.002","90","","90","","90","","10242.9","1.3","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C25 H28 N4 O6 Zn -","- C25 H24 N4 O6 Zn -","- C400 H384 N64 O96 Zn16 -","16","0.5","","Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju","Construction of helical networks by using multiple V-shaped mixed ligand systems","CrystEngComm","2012","14","2","561","","10.1039/c1ce05380a","","","0.71073","MoKα","","0.0543","0.0406","","","0.1112","0.121","","","","","","1.065","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7207034","23.129","0.005","39.47","0.008","40.61","0.008","90","","90","","90","","37073","13","294","2","294","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C30 H26 In N O9 -","- C30 H20 In N O9 -","- C960 H640 In32 N32 O288 -","32","1","","Zhou, Guangpeng; Yang, Yulin; Fan, Ruiqing; Cao, Wenwu; Yang, Bin","From two-dimensional trapezoid-like layer to three-dimensional porous indium-4,4′-biphenyldicarboxylate MOFs","CrystEngComm","2012","14","1","193","","10.1039/c1ce05841j","","","0.71073","MoKα","","0.1479","0.0696","","","0.1404","0.1613","","","","","","1.035","","","","has coordinates,has disorder","180401","2020-10-21","18:00:00",""
"7207421","25.054","0.002","13.2154","0.0009","17.3885","0.0013","90","","90","","90","","5757.3","0.7","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C16 H28 Cl2 Cu N12 O10 -","- C16 H28 Cl2 Cu N12 O10 -","- C128 H224 Cl16 Cu8 N96 O80 -","8","0.25","","Tian, Li; Chen, Zhi; Yu, Ao; Song, Hai-Bin; Cheng, Peng","Novel flexible bis-triazole bridged copper(ii) coordination polymers varying from one- to three-dimensionality","CrystEngComm","2012","14","6","2032","","10.1039/c2ce06204f","","","0.71073","MoKα","","0.0713","0.0616","","","0.1807","0.1874","","","","","","1.073","","","","has coordinates,has disorder","180405","2020-10-21","18:00:00",""
"7207492","23.76","0.005","39.331","0.008","40.61","0.009","90","","90","","90","","37950","14","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C60 H50 In2 N2 O17 -","- C60 H32 In2 N2 O17 -","- C960 H512 In32 N32 O272 -","16","0.5","","Gu, Ja-Min; Kim, Sung-Jin; Kim, Youngmee; Huh, Seong","Structural isomerism of an anionic nanoporous In-MOF with interpenetrated diamond-like topology","CrystEngComm","2012","14","5","1819","","10.1039/c2ce06538j","","","0.71073","MoKα","","0.18","0.0602","","","0.1754","0.2017","","","","","","0.78","","","","has coordinates","180405","2020-10-21","18:00:00",""
"7207493","23.088","0.003","39.262","0.005","41.133","0.005","90","","90","","90","","37286","8","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C56 H32 In2 O16 -","- C56 H32 In2 O16 -","- C896 H512 In32 O256 -","16","0.5","","Gu, Ja-Min; Kim, Sung-Jin; Kim, Youngmee; Huh, Seong","Structural isomerism of an anionic nanoporous In-MOF with interpenetrated diamond-like topology","CrystEngComm","2012","14","5","1819","","10.1039/c2ce06538j","","","0.71073","MoKα","","0.1483","0.0686","","","0.1946","0.2091","","","","","","0.822","","","","has coordinates","180405","2020-10-21","18:00:00",""
"7207843","14.0772","0.0011","21.7338","0.0018","31.559","0.003","90","","90","","90","","9655.5","1.4","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C17 H24 Ag2 I4 N2 -","- C17 H24 Ag2 I4 N2 -","- C272 H384 Ag32 I64 N32 -","16","0.5","","Qiao, Yong-Zhen; Fu, Wen-Zhen; Yue, Jun-Ming; Liu, Xiu-Cun; Niu, Yun-Yin; Hou, Hong-Wei","Role of cooperative templates in the self-assembly process of microporous structures: syntheses and characterization of 12 new silver halide/thiocyanate supramolecular polymers","CrystEngComm","2012","14","9","3241","","10.1039/c2ce06687d","","","0.71073","MoKα","","0.053","0.0275","","","0.0661","0.0844","","","","","","1.074","","","","has coordinates","180409","2020-10-21","18:00:00",""
"7208332","14.07","0.004","15.3","0.004","27.431","0.008","90","","90","","90","","5905","3","123","","123","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C1.5 H6 As5 N S8 -","- C1.5 H6 As5 N S8 -","- C24 H96 As80 N16 S128 -","16","0.5","","Du, Ke-Zhao; Feng, Mei-Ling; Li, Jian-Rong; Huang, Xiao-Ying","pH-induced solvothermal synthesis and characterization of two novel thioarsenate compounds: Three-dimensional (1,2-pdaH2)0.5As5S8 containing ψ-As(iii)S4 and two-dimensional (NH4)2As8S13","CrystEngComm","2012","14","15","4959","","10.1039/c2ce25475a","","","0.71073","MoKα","","0.0227","0.0205","","","0.0491","0.0497","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208969","15.1007","0.001","17.2538","0.0011","31.509","0.002","90","","90","","90","","8209.5","0.9","296","2","296","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C20 H12 Cd N10 -","- C20 H12 Cd N10 -","- C320 H192 Cd16 N160 -","16","0.5","","Ma, Li; Yu, Naiqian; Chen, Susu; Deng, Hong","Construction of diverse CdII/ZnII coordination polymers based on 5-(quinolyl)tetrazolate generated via in situ hydrothermal synthesis","CrystEngComm","2013","15","7","1352","","10.1039/c2ce26323h","","","0.71073","MoKα","","0.0258","0.0217","","","0.0593","0.0613","","","","","","1.082","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7209022","12.4527","0.0018","13.616","0.002","13.984","0.002","90","","90","","90","","2371.1","0.6","291","2","291","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C2 H6 Mn O6 S -","- C2 H6 Mn O6 S -","- C32 H96 Mn16 O96 S16 -","16","0.5","","Ge, Gen-Wu; Qi, Zhi-Yuan; Miao, Yu-Run; Du, Hong-Bin; You, Xiao-Zeng","The synthesis, structure and magnetism studies of two manganese sulfates with a 3D zeolite GIS framework and 1D chain structure","CrystEngComm","2013","15","3","435","","10.1039/c2ce26441b","","","0.71073","MoKα","","0.021","0.0202","","","0.0553","0.0558","","","","","","1.05","","","","has coordinates","180421","2020-10-21","18:00:00",""
"7209307","6.2185","","10.5633","","12.1729","","90","","90","","90","","799.612","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Ag Hg (As O4)","","- Ag As Hg O4 -","- Ag As Hg O4 -","- Ag8 As8 Hg8 O32 -","8","0.25","","Weil, M.","Investigations in the systems Ag - Hg - X - O (X = As(V), Se(IV), Se(VI)): hydrothermal single crystal growth of Ag3 As O4, Ag Hg(I)2 As O4, Ag Hg(II) As O4, Ag2 Se O4 and the crystal structure of Ag2 Hg(II) (Se O3)2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2003","58","","1091","1096","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209359","6.0531","","10.3898","","13.0001","","90","","90","","90","","817.583","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ag2 (Se O4)","","- Ag2 O4 Se -","- Ag2 O4 Se -","- Ag16 O32 Se8 -","8","0.25","","Weil, M.","Investigations in the systems Ag - Hg - X - O (X = As(V), Se(IV), Se(VI)): hydrothermal single crystal growth of Ag3 As O4, Ag Hg(I)2 As O4, Ag Hg(II) As O4, Ag2 Se O4 and the crystal structure of Ag2 Hg(II) (Se O3)2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2003","58","","1091","1096","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209684","17.083","0.012","22.908","0.016","23.481","0.015","90","","90","","90","","9189","11","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C16 H22 N6 O2 S2 Zn -","- C16 H18 N6 O2 S2 Zn -","- C256 H288 N96 O32 S32 Zn16 -","16","0.5","","Wen, Yuehong; Sheng, Tianlu; Hu, Shengmin; Wang, Yanlong; Tan, Chunhong; Ma, Xiao; Xue, Zhenzhen; Wang, Yong; Wu, Xintao","Effect of anions on the self-assembly of Zn(ii) with a hydrogenated Schiff base ligand: structural diversity and photoluminescent properties","CrystEngComm","2013","15","14","2714","","10.1039/c3ce26937j","","","0.71073","MoKα","","0.0938","0.0747","","","0.2358","0.2599","","","","","","1.085","","","","has coordinates","180427","2020-10-21","18:00:00",""
"7209981","14.1543","0.0012","15.7359","0.001","27.1076","0.0017","90","","90","","90","","6037.7","0.7","295","2","295","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H20 I8 N8 -","- C12 H20 I8 N8 -","- C96 H160 I64 N64 -","8","0.25","","Węcławik, Magdalena; Gągor, Anna; Piecha, Anna; Jakubas, Ryszard; Medycki, Wojciech","Synthesis, crystal structure and phase transitions of a series of imidazolium iodides","CrystEngComm","2013","15","28","5633","","10.1039/c3ce40559a","","","0.71073","MoKα","","0.1018","0.0343","","","0.0869","0.1057","","","","","","0.834","","","","has coordinates,has disorder","180430","2020-10-21","18:00:00",""
"7210028","7.4891","0.0019","13.333","0.002","51.316","0.008","90","","90","","90","","5124","1.7","296","2","296","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C12 H10 F4 N4 -","- C12 H10 F4 N4 -","- C192 H160 F64 N64 -","16","0.5","","Eberhard, Jens; Stoll, Ion; Brockhinke, Regina; Neumann, Beate; Stammler, Hans-Georg; Riefer, Arthur; Rauls, Eva; Schmidt, Wolf Gero; Mattay, Jochen","Structural variety of 5-fluoroarene-2-aminopyrimidine in comparison to 2-aminopyrimidine silver(i) coordination polymers: progress report and overview","CrystEngComm","2013","15","21","4225","","10.1039/c2ce26388b","","","0.71073","MoKα","","0.0617","0.0416","","","0.0968","0.1067","","","","","","1.109","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210091","22.264","0.012","28.623","0.016","29.104","0.015","90","","90","","90","","18547","17","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H14 Eu N3 O7 -","- C24 H14 Eu N3 O7 -","- C768 H448 Eu32 N96 O224 -","32","1","","Zhang, Xiutang; Fan, Liming; Sun, Zhong; Zhang, Wei; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and luminescence of four lanthanide metal‒organic frameworks based on lanthanide-oxide chains with C2- or C3-symmetric trigonal-planar polycarboxylate ligands","CrystEngComm","2013","15","24","4910","","10.1039/c3ce27082c","","","0.71073","MoKα","","0.0459","0.0359","","","0.1287","0.1336","","","","","","0.996","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210094","22.304","0.003","28.721","0.004","29.158","0.004","90","","90","","90","","18678","4","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H14 N3 O7 Sm -","- C24 H12 N3 O7 Sm -","- C768 H384 N96 O224 Sm32 -","32","1","","Zhang, Xiutang; Fan, Liming; Sun, Zhong; Zhang, Wei; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and luminescence of four lanthanide metal‒organic frameworks based on lanthanide-oxide chains with C2- or C3-symmetric trigonal-planar polycarboxylate ligands","CrystEngComm","2013","15","24","4910","","10.1039/c3ce27082c","","","0.71073","MoKα","","0.0512","0.0403","","","0.1308","0.1373","","","","","","0.997","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210248","24.8713","0.0015","28.3131","0.0016","52.118","0.003","90","","90","","90","","36701","4","296","2","296","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C90 H222 Co8 In16 N30 O5 S37 -","- C72 H120 Co8 In16 N24 S37 -","- C576 H960 Co64 In128 N192 S296 -","8","0.25","","Wang, Yu-Hong; Jiang, Jian-Bing; Wang, Peng; Sun, Xiao-Lu; Zhu, Qin-Yu; Dai, Jie","Polymeric supertetrahedral InS clusters assembled by new linkages","CrystEngComm","2013","15","30","6040","","10.1039/c3ce40270c","","","0.71073","MoKα","","0.1322","0.117","","","0.1907","0.1963","","","","","","1.167","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7210695","22.128","0.013","28.524","0.016","29.033","0.018","90","","90","","90","","18325","19","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H12 N3 O7 Y -","- C24 H12 N3 O7 Y -","- C768 H384 N96 O224 Y32 -","32","1","","Zhang, Huabin; Lin, Ping; Zou, Guodong; Shan, Xiaochen; Du, Fenglei; Du, Shaowu","An unusual highly connected 3D net with hydrophilic pore surface","CrystEngComm","2013","15","15","3016","","10.1039/c3ce26788a","","","0.71073","MoKα","","0.1045","0.087","","","0.2005","0.2113","","","","","","1.033","","","","has coordinates","180437","2020-10-21","18:00:00",""
"7211070","8.2003","0.0016","14.187","0.003","16.869","0.003","90","","90","","90","","1962.5","0.7","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Au0.98 Si3.02 Yb2 -","- Au0.982 Si3.018 Yb2 -","- Au15.712 Si48.288 Yb32 -","16","0.5","","Sarkar, Sumanta; Gutmann, Matthias J.; Peter, Sebastian C.","Crystal structure and physical properties of indium flux grown RE2AuSi3 (RE = Eu, Yb)","CrystEngComm","2013","15","39","8006","","10.1039/c3ce41198b","","","0.71073","MoKα","","0.0793","0.0433","","","0.088","0.1017","","","","","","1.034","","","","has coordinates","180441","2020-10-21","18:00:00",""
"7211411","12.412","0.005","16.372","0.007","31.497","0.013","90","","90","","90","","6400","5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H17 Cu N4 O4 -","- C16 H17 Cu N4 O4 -","- C256 H272 Cu16 N64 O64 -","16","0.5","","Guo, Xiang-Guang; Yang, Wen-Bin; Wu, Xiao-Yuan; Zhang, Qi-Kai; Lu, Can-Zhong","Construction of coordination polymers based on methylenebis(3,5-dimethylpyrazole) and varied aromatic carboxylic acids","CrystEngComm","2013","15","46","10107","","10.1039/c3ce41575a","","","0.71073","MoKα","","0.0454","0.0364","","","0.1247","0.1379","","","","","","1.007","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7214878","12.313","0.002","22.626","0.005","34.702","0.007","90","","90","","90","","9668","3","298","2","298","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C40 H28 Cl3 N12 O22 Sm Zn6 -","- C40 H28 Cl3 N12 O22 Sm Zn6 -","- C320 H224 Cl24 N96 O176 Sm8 Zn48 -","8","0.25","","Cai, Song-Liang; Zheng, Sheng-Run; Wen, Zhen-Zhen; Fan, Jun; Zhang, Wei-Guang","Construction of luminescent three-dimensional Ln(iii)‒Zn(ii) heterometallic coordination polymers based on 2-pyridyl imidazole dicarboxylate","CrystEngComm","2012","14","23","8236","","10.1039/c2ce25803j","","","0.71073","MoKα","","0.0787","0.0606","","","0.2122","0.2352","","","","","","1.051","","","","has coordinates","180479","2020-10-21","18:00:00",""
"7214879","12.284","0.002","22.733","0.004","34.4","0.006","90","","90","","90","","9606","3","173","2","173","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C40 H28 Cl3 Eu N12 O22 Zn6 -","- C40 H28 Cl3 Eu N12 O22 Zn6 -","- C320 H224 Cl24 Eu8 N96 O176 Zn48 -","8","0.25","","Cai, Song-Liang; Zheng, Sheng-Run; Wen, Zhen-Zhen; Fan, Jun; Zhang, Wei-Guang","Construction of luminescent three-dimensional Ln(iii)‒Zn(ii) heterometallic coordination polymers based on 2-pyridyl imidazole dicarboxylate","CrystEngComm","2012","14","23","8236","","10.1039/c2ce25803j","","","1.54178","CuKα","","0.0512","0.0499","","","0.1629","0.1651","","","","","","1.062","","","","has coordinates","180479","2020-10-21","18:00:00",""
"7214880","12.1678","0.0005","22.691","0.0008","34.3938","0.0014","90","","90","","90","","9496.1","0.6","173","2","173","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C40 H28 Cl3 N12 O22 Tb Zn6 -","- C40 H28 Cl3 N12 O22 Tb Zn6 -","- C320 H224 Cl24 N96 O176 Tb8 Zn48 -","8","0.25","","Cai, Song-Liang; Zheng, Sheng-Run; Wen, Zhen-Zhen; Fan, Jun; Zhang, Wei-Guang","Construction of luminescent three-dimensional Ln(iii)‒Zn(ii) heterometallic coordination polymers based on 2-pyridyl imidazole dicarboxylate","CrystEngComm","2012","14","23","8236","","10.1039/c2ce25803j","","","1.54178","CuKα","","0.0525","0.0493","","","0.1634","0.1701","","","","","","0.981","","","","has coordinates","180479","2020-10-21","18:00:00",""
"7215068","19.743","0.0003","26.8524","0.0005","29.2175","0.0005","90","","90","","90","","15489.6","0.5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C36 H34 N4 O16 Zn3 -","- C20 H4 O16 Zn3 -","- C320 H64 O256 Zn48 -","16","0.5","","Ji, Wen-Juan; Hu, Man-Cheng; Li, Shu-Ni; Jiang, Yu-Cheng; Zhai, Quan-Guo","Ionic liquids used for synthesis of supramolecular isomeric open-frameworks as photocatalysts for visible-light-driven degradation of organic dyes","CrystEngComm","2014","16","17","3474","","10.1039/c4ce00014e","","","0.71073","MoKα","","0.0315","0.0291","","","0.107","0.1083","","","","","","1.014","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215387","13.143","0.002","17.513","0.003","25.348","0.004","90","","90","","90","","5834.4","1.6","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C16 H28 Cl2 Cu N12 O10 -","- C16 H28 Cl2 Cu N12 O9.98 -","- C128 H224 Cl16 Cu8 N96 O79.84 -","8","0.25","","Zhu, Xia; Wang, Li-Yan; Liu, Xun-Gao; Wang, Ju; Li, Bao-Long; Li, Hai-Yan","Structural versatility of seven copper(ii) coordination polymers constructed with the long flexible ligand 1,4-bis(1,2,4-triazol-1-yl)butane","CrystEngComm","2011","13","20","6090","","10.1039/c1ce05466j","","","0.7107","MoKα","","0.0554","0.0539","","","0.1541","0.1555","","","","","","1.099","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215388","12.887","0.002","17.043","0.003","24.799","0.004","90","","90","","90","","5446.7","1.6","193","2","193","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H28 Cu N14 O8 -","- C16 H28 Cu N14 O8 -","- C128 H224 Cu8 N112 O64 -","8","0.25","","Zhu, Xia; Wang, Li-Yan; Liu, Xun-Gao; Wang, Ju; Li, Bao-Long; Li, Hai-Yan","Structural versatility of seven copper(ii) coordination polymers constructed with the long flexible ligand 1,4-bis(1,2,4-triazol-1-yl)butane","CrystEngComm","2011","13","20","6090","","10.1039/c1ce05466j","","","0.7107","MoKα","","0.0758","0.0726","","","0.2078","0.2107","","","","","","1.315","","","","has coordinates","180484","2020-10-21","18:00:00",""
"7215917","15.7239","0.0019","16.158","0.002","40.866","0.01","90","","90","","90","","10383","3","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C15 H11 Co N2 O6 S2 -","- C15 H11 Co N2 O6 S2 -","- C240 H176 Co16 N32 O96 S32 -","16","0.5","","Sanda, Suresh; Goswami, Soumyabrata; Jena, Himanshu Sekhar; Parshamoni, Srinivasulu; Konar, Sanjit","A family of three magnetic metal organic frameworks: their synthesis, structural, magnetic and vapour adsorption study","CrystEngComm","2014","16","22","4742","","10.1039/c3ce42451k","","","0.71073","MoKα","","0.0848","0.0846","","","0.2473","0.2475","","","","","","1.117","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7216448","26.6699","0.0005","37.3628","0.0009","54.356","0.001","90","","90","","90","","54163.7","1.9","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C89 H105.2 N5 O42.6 S8 -","- C89 H75 N5 O42.6 S8 -","- C1424 H1200 N80 O681.6 S128 -","16","0.5","","Lesniewska, B.; Perret, F.; Suwinska, K.; Coleman, A. W.","Structural characterization of inclusion complexes of para-sulphonato-calix[8]arene with 1,2-bis(4-pyridyl)-ethane and 1,3-bis(4-pyridyl)-propane. New ‘double cone’ and ‘up‒flat‒down’ conformations of para-sulphonato-calix[8]arene","CrystEngComm","2014","16","21","4399","","10.1039/c3ce42303d","","","0.71073","MoKα","","0.1805","0.1429","","","0.3737","0.3943","","","","","","1.612","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7218674","17.001","0.0019","19.633","0.002","23.109","0.004","90","","90","","90","","7713.3","1.8","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H15 Mn N3 O5 -","- C12 H6 Mn N2 O4 -","- C192 H96 Mn16 N32 O64 -","16","0.5","","Wang, Jing; Jing, Xuemin; Cao, Yu; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Structural diversity and magnetic properties of three metal‒organic frameworks assembled from a T-shaped linker","CrystEngComm","2015","17","3","604","","10.1039/C4CE01799D","","","0.71073","MoKα","","0.1079","0.075","","","0.2098","0.2325","","","","","","1.105","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218691","13.868","0.003","22.973","0.004","24.215","0.004","90","","90","","90","","7715","2","296","2","296","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C9 H9 Cu N3 -","- C9 H9 Cu N3 -","- C288 H288 Cu32 N96 -","32","1","","Huang, RongYi; Xue, Chen; Zhu, Chang-Hai; Wang, Zhu-Qing; Xu, Heng; Ren, Xiao-Ming","Charge-transfer metal-organic frameworks based on CuCN architecture units: crystal structures, luminescence properties and theoretical investigations","RSC Adv.","2014","","","","","10.1039/C4RA11652F","","","0.71073","MoKα","","0.052","0.0387","","","0.1046","0.1101","","","","","","1.004","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7220420","14.093","0.003","26.67","0.005","28.668","0.006","90","","90","","90","","10775","4","223","2","223","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C24 H18 N2 O4 Zn -","- C24 H16 N2 O4 Zn -","- C384 H256 N32 O64 Zn16 -","16","0.5","","Liu, Dong; Ge, Yu; Li, Ni-Ya; Ma, Wei; Tang, Xiaoyan","Coordination assemblies of Zn(NO3)2 with 4-pyr-poly-2-ene and polycarboxylates: structural diversification and photoluminescence properties","RSC Adv.","2015","","","","","10.1039/C5RA07371E","","","0.71073","MoKα","","0.0829","0.0656","","","0.1884","0.2016","","","","","","1.102","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222137","14.5012","0.0011","44.132","0.002","50.412","0.002","90","","90","","90","","32262","3","291","2","291","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H10 Eu N O8 -","- C16 H10 Eu N O8 -","- C512 H320 Eu32 N32 O256 -","32","1","","Duan, Jingui; Zou, Changchang; Li, Qianqian; Jin, Wanqin","New luminescent porous coordination polymers with an acylamide-decorated linker for anion recognition and reversible I2accommodation","CrystEngComm","2015","17","43","8226","","10.1039/C5CE01725D","","","0.71073","MoKα","","0.0642","0.0459","","","0.1039","0.1086","","","","","","1.013","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222138","14.4927","0.0011","44.273","0.002","50.103","0.002","90","","90","","90","","32148","3","291","2","291","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H10 N O8 Tb -","- C16 H10 N O8 Tb -","- C512 H320 N32 O256 Tb32 -","32","1","","Duan, Jingui; Zou, Changchang; Li, Qianqian; Jin, Wanqin","New luminescent porous coordination polymers with an acylamide-decorated linker for anion recognition and reversible I2accommodation","CrystEngComm","2015","17","43","8226","","10.1039/C5CE01725D","","","0.71073","MoKα","","0.0561","0.0372","","","0.0878","0.0961","","","","","","1.025","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222723","5.598","","13.512","","23.854","","90","","90","","90","","1804.32","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 (Cu Ta S4)","","- Cu Rb2 S4 Ta -","- Cu Rb2 S4 Ta -","- Cu8 Rb16 S32 Ta8 -","8","0.25","","Wu, Y.; Naether, C.; Bensch, W.","Low dimensional materials: syntheses structures, and optical properties of Rb2 Cu Ta S4, Rb2 Cu Ta Se4, Rb Cu2 Ta Se4, K3 Ag3 Ta2 Se8, and Rb3 Ag Ta2 Se12","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2004","59","","1006","1014","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222724","5.782","","13.924","","24.653","","90","","90","","90","","1984.78","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 (Cu Ta Se4)","","- Cu Rb2 Se4 Ta -","- Cu Rb2 Se4 Ta -","- Cu8 Rb16 Se32 Ta8 -","8","0.25","","Wu, Y.; Naether, C.; Bensch, W.","Low dimensional materials: syntheses structures, and optical properties of Rb2 Cu Ta S4, Rb2 Cu Ta Se4, Rb Cu2 Ta Se4, K3 Ag3 Ta2 Se8, and Rb3 Ag Ta2 Se12","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2004","59","","1006","1014","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222771","6.1202","","11.546","","11.8262","","90","","90","","90","","835.685","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","Sr (N3)2","","- N6 Sr -","- N6 Sr -","- N48 Sr8 -","8","0.25","","Reckeweg, O.; Simon, A.","Azide und Cyanamide - aehnlich und doch anders","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2003","58","","1097","1104","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222915","7.24","","10.93","","21.68","","90","","90","","90","","1715.61","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Na3 (Y (N H2)6)","","- H12 N6 Na3 Y -","- H12 N6 Na3 Y -","- H96 N48 Na24 Y8 -","8","0.25","","Stuhr, A.; Jacobs, H.; Juza, R.","Die Kristallstruktur des Na3 (Y (N H2)6)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1970","25","","1483","1483","","","","","","","","","","","","","","","","","","","","","","has coordinates","189056","2020-10-21","18:00:00",""
"7223148","10.5042","0.0013","43.81","0.004","43.81","0.004","90","","90","","90","","20161","4","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H22 Cd N2 O4 -","- C27 H22 Cd N2 O4 -","- C864 H704 Cd32 N64 O128 -","32","1","","Fan, Ting-Ting; Li, Jia-Jia; Qu, Xiang-Long; Han, Hong-Liang; Li, Xia","Metal(ii)‒organic frameworks with 3,3′-diphenyldicarboxylate and 1,3-bis(4-pyridyl)propane: preparation, crystal structures and luminescence","CrystEngComm","2015","17","48","9443","","10.1039/C5CE01772F","","","0.71073","MoKα","","0.0663","0.0422","","","0.0941","0.1101","","","","","","1.067","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7223470","8.785","0.006","20.81","0.014","34.48","0.02","90","","90","","90","","6303","7","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","catena-(tris(m4-Terephthalato)-di-scandium)","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McKellar, Scott C.; Sotelo, Jorge; Mowat, John P. S.; Wright, Paul A.; Moggach, Stephen A.","Perfluorocarbon liquid under pressure: a medium for gas delivery","CrystEngComm","2016","18","8","1273","","10.1039/C5CE01989C","","","0.71073","MoKα","","0.0449","0.0305","","0.0643","0.0594","0.0643","","","","","","0.9995","","","","has coordinates","177752","2020-10-21","18:00:00",""
"7223471","8.798","0.002","20.865","0.004","34.551","0.006","90","","90","","90","","6343","2","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","Sc2BDC3","catena-(tris(m4-Terephthalato)-di-scandium)","","- C12 H6 O6 Sc -","- C12 H6 O6 Sc -","- C192 H96 O96 Sc16 -","16","0.5","","McKellar, Scott C.; Sotelo, Jorge; Mowat, John P. S.; Wright, Paul A.; Moggach, Stephen A.","Perfluorocarbon liquid under pressure: a medium for gas delivery","CrystEngComm","2016","18","8","1273","","10.1039/C5CE01989C","","","0.71073","MoKα","","0.0805","0.0491","","0.1114","0.0959","0.1114","","","","","","0.9315","","","","has coordinates","177752","2020-10-21","18:00:00",""
"7230731","17.338","0.001","42.746","0.002","43.404","0.002","90","","90","","90","","32168","3","150","2","150","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C24.375 H20.75 Cd Cl0.75 F6 N4 O6.5 S2 -","- C24.375 H20.75 Cd Cl0.75 F6 N4 O6.5 S2 -","- C780 H664 Cd32 Cl24 F192 N128 O208 S64 -","32","1","","Rizzato, Silvia; Moret, Massimo; Beghi, Fabio; Lo Presti, Leonardo","Crystallization and structural properties of a family of isotopological 3D-networks: the case of a 4,4′-bipy ligand‒M2+ triflate system","CrystEngComm","2018","20","26","3784","","10.1039/C8CE00653A","","x-ray","0.71073","MoKα","","0.0968","0.0846","","","0.2594","0.2721","","","","","","1.077","","","","has coordinates,has disorder","228989","2020-10-21","18:00:00",""
"7230732","16.993","0.009","42.006","0.002","42.426","0.002","90","","90","","90","","30284","16","120","2","120","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C22 H16.75 F6 Fe N4 O6.375 S2 -","- C22 H16 F6 Fe N4 O6.376 S2 -","- C704 H512 F192 Fe32 N128 O204.032 S64 -","32","1","","Rizzato, Silvia; Moret, Massimo; Beghi, Fabio; Lo Presti, Leonardo","Crystallization and structural properties of a family of isotopological 3D-networks: the case of a 4,4′-bipy ligand‒M2+ triflate system","CrystEngComm","2018","20","26","3784","","10.1039/C8CE00653A","","x-ray","0.71073","MoKα","","0.1178","0.1085","","","0.3232","0.3311","","","","","","1.472","","","","has coordinates,has disorder","228989","2020-10-21","18:00:00",""
"7231931","22.73","0.02","26.88","0.02","28.36","0.04","90","","90","","90","","17327","3","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- C44 H52 O11 -","- C44 H52 O11 -","- C704 H832 O176 -","16","0.5","","Xiao, Zufeng; Yang, Weiping; Yan, Fengyi; Ji, Lingbo; Li, Wei; Wang, Wei","Assembly of calix[4]arene carboxylic acid derivatives by hydrogen bonding","CrystEngComm","2019","21","3","439","","10.1039/C8CE01655K","","","0.71073","MoKα","","0.0963","0.0755","","","0.2592","0.2927","","","","","","1.185","","","","has coordinates,has disorder","223738","2020-10-21","18:00:00",""
"7235764","7.3968","0.0053","36.3567","0.0025","63.4375","0.0097","90","","90","","90","","17060","13","298","","298","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","tris(1,4-bis(1H-pyrazol-4-ylethynyl)benzene)-bis(fe(iii))","","- C48 H24 Fe2 N12 -","- C48 H24 Fe2 N12 -","- C384 H192 Fe16 N96 -","8","0.25","","Galli, S.; Maspero, A.; Giacobbe, C.; Palmisano, G.; Nardo, L.; Comotti, A.; Bassanetti, I.; Sozzani, P.; Masciocchi, N.","When long bis(pyrazolates) meet late transition metals: structure, stability and adsorption of metal‒organic frameworks featuring large parallel channels","Journal of Materials Chemistry A","2014","2","31","12208","","10.1039/C4TA01798F","powder diffraction","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","233305","2020-10-21","18:00:00",""
"7236139","16.7581","0.0007","18.8268","0.0009","38.9998","0.0018","90","","90","","90","","12304.5","1","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","VNU-15","","- C18 H21 Fe2 N2 O14 S2 -","- C18 H21 Fe2 N2 O14 S2 -","- C288 H336 Fe32 N32 O224 S32 -","16","0.5","","Tu, Thach N.; Phan, Nghi Q.; Vu, Thanh T.; Nguyen, Ha L.; Cordova, Kyle E.; Furukawa, Hiroyasu","High proton conductivity at low relative humidity in an anionic Fe-based metal‒organic framework","Journal of Materials Chemistry A","2016","4","10","3638","","10.1039/C5TA10467J","","","1.54178","CuKα","","0.0768","0.0547","","","0.1226","0.1324","","","","","","1.07","","","","has coordinates,has disorder","233954","2020-10-21","18:00:00",""
"7236586","11.3815","0.0001","20.5728","0.0005","34.5573","0.0005","90","","90","","90","","8091.6","0.2","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C15 H12 Co N5 O6 -","- C15 H12 Co N5 O6 -","- C240 H192 Co16 N80 O96 -","16","0.5","","Rajak, Richa; Saraf, Mohit; Mohammad, Akbar; Mobin, Shaikh M.","Design and construction of a ferrocene based inclined polycatenated Co-MOF for supercapacitor and dye adsorption applications","Journal of Materials Chemistry A","2017","5","34","17998","","10.1039/C7TA03773B","","","1.5418","CuKα","","0.0549","0.0463","","","0.1393","0.1472","","","","","","1.104","","","","has coordinates","236331","2020-10-21","18:00:00",""
"7237770","20.752","0.001","24.4248","0.0014","29.3054","0.0016","90","","90","","90","","14853.8","1.4","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C34 H36 N5 O13 P3 Zn3 -","- C34 H26 N5 O12 P3 Zn3 -","- C544 H416 N80 O192 P48 Zn48 -","16","0.5","","Ge, Bang-Di; Han, Song-De; Wei, Qi; Li, Jin-Hua; Wang, Guo-Ming","Coordination-driven strategy towards crystalline hybrid photochromic materials via the marriage of a non-photochromic extended dipyridine unit and zincophosphate","Journal of Materials Chemistry C","2019","7","13","3920","","10.1039/C9TC00851A","","","0.71073","MoKα","","0.0719","0.0472","","","0.1356","0.1517","","","","","","0.916","","","","has coordinates,has disorder","238596","2020-10-21","18:00:00",""
"7239067","12.0412","0.0008","23.6221","0.0017","25.381","0.002","90","","90","","90","","7219.3","0.9","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C24 H16 Ag In N4 O8 -","- C24 H16 Ag In N4 O8 -","- C192 H128 Ag8 In8 N32 O64 -","8","0.25","","Tan, Yan-Xi; He, Yan-Ping; Wang, Min; Zhang, Jian","A water-stable zeolite-like metal‒organic framework for selective separation of organic dyes","RSC Adv.","2014","4","3","1480","","10.1039/C3RA41627E","","","0.71073","MoKα","","0.0784","0.0614","","","0.2028","0.2261","","","","","","1.084","","","","has coordinates","244533","2020-10-21","18:00:00",""
"7239068","12.4623","0.0007","22.5494","0.0009","24.692","0.002","90","","90","","90","","6938.9","0.7","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C24 H16 Cu In N4 O8 -","- C24 H16 Cu In N4 O8 -","- C192 H128 Cu8 In8 N32 O64 -","8","0.25","","Tan, Yan-Xi; He, Yan-Ping; Wang, Min; Zhang, Jian","A water-stable zeolite-like metal‒organic framework for selective separation of organic dyes","RSC Adv.","2014","4","3","1480","","10.1039/C3RA41627E","","","0.71073","MoKα","","0.0667","0.0539","","","0.1978","0.2098","","","","","","1.288","","","","has coordinates","244533","2020-10-21","18:00:00",""
"7244268","13.6541","0.0005","20.9932","0.001","33.7804","0.0015","90","","90","","90","","9682.9","0.7","120.01","0.19","120.01","0.19","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C46 H50 Cl2 Cu N10 O12 -","- C46 H50 Cl2 Cu N10 O12 -","- C368 H400 Cl16 Cu8 N80 O96 -","8","0.25","","Bao, Lihong; Jones, Leighton O.; Garrote Cañas, Ana M.; Yan, Yunhan; Pask, Christopher M.; Hardie, Michaele J.; Mosquera, Martin A.; Schatz, George C.; Sergeeva, Natalia N.","Multipurpose made colorimetric materials for amines, pH change and metal ion detection","RSC Advances","2022","12","5","2684","2692","10.1039/D1RA07811A","","x-ray","1.54184","CuKα","","0.0757","0.0675","","","0.1857","0.1934","","","","","","1.057","","","","has coordinates","272181","2022-01-21","02:14:13",""
"7244279","22.3041","0.0009","28.6028","0.0014","29.0127","0.0013","90","","90","","90","","18508.9","1.4","292.4","0.3","292.4","0.3","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C408 H248 Eu16 N52 O112 -","- C408 H248 Eu16 N52 O112 -","- C816 H496 Eu32 N104 O224 -","2","0.0625","","Sun, Yin-Xia; Guo, Geng; Ding, Wen-Min; Han, Wen-Yu; Li, Juan; Deng, Zhe-Peng","A highly stable Eu-MOF multifunctional luminescent sensor for the effective detection of Fe3+, Cr2O72−/CrO42− and aspartic acid in aqueous systems","CrystEngComm","2022","24","7","1358","1367","10.1039/D1CE01432C","","x-ray","1.54184","CuKα","","0.0478","0.0401","","","0.09","0.0946","","","","","","1.051","","","","has coordinates","273359","2022-03-04","22:09:53",""
"7244304","8.9823","0.0002","11.4355","0.0004","48.3424","0.0013","90","","90","","90","","4965.6","0.2","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C16 H18 F8 K O17 Sc -","- C16 H18 F8 K O17 Sc -","- C128 H144 F64 K8 O136 Sc8 -","8","0.25","","Cheplakova, Anastasia M.; Samsonenko, Denis G.; Lazarenko, Vladimir; Dorovatovskii, Pavel; Zubavichus, Yan; Khrustalev, Victor N.; Rakhmanova, Marianna I.; Fedin, Vladimir P.","Synthesis, supramolecular isomerism, and photoluminescence of scandium(III) complexes with tetrafluoroterephthalate ligand","CrystEngComm","2022","","","","","10.1039/D1CE01689J","","x-ray","0.71073","MoKα","","0.023","0.0221","","","0.0637","0.0642","","","","","","1.074","","","","has coordinates,has disorder","272261","2022-01-26","23:42:54",""
"7244902","12.9348","0.0002","22.8426","0.0004","39.6053","0.0006","90","","90","","90","","11702","0.3","200","","200","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C56 H60 I4 N4 O5 -","- C56 H60 I4 N4 O5 -","- C448 H480 I32 N32 O40 -","8","0.25","","Gullo, Maria Chiara; Marchiò, Luciano; Casnati, Alessandro; Baldini, Laura","Halogen-bonded architectures of multivalent calix[4]arenes","CrystEngComm","2022","","","","","10.1039/D2CE00193D","","","0.71073","MoKα","","0.0338","0.0246","","","0.0543","0.0601","","","","","","1.067","","","","has coordinates,has disorder","275153","2022-05-06","22:33:56",""
"7245425","18.8851","0.0018","20.5134","0.0019","31.983","0.004","90","","90","","90","","12390","2","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C31 H23 Cl2 N5 O7 Zn2 -","- C31 H23 Cl2 N5 O7 Zn2 -","- C496 H368 Cl32 N80 O112 Zn32 -","16","0.5","","Bazargan, Maryam; Mirzaei, Masoud; Hamid, Abdul Samad; Kafshdar, Zahra Heydaralizadeh; Ziaekhodadadian, Hoda; Mague, Joel T.; Momenzadeh, Elham; Gil, Diego Mauricio; Gomila, Rosa Maria; Frontera, Antonio","On the importance of π-stacking interactions in Zn and Cu complexes bearing pyridine-2,6-dicarboxylic acid N-oxide and N-donor auxiliary ligands","CrystEngComm","2022","","","","","10.1039/D2CE00656A","","","0.71073","Mo–Kα","","0.0334","0.0285","","","0.0791","0.0813","","","","","","1.067","","","","has coordinates,has disorder","277606","2022-09-02","22:43:00",""
"7246368","15.7544","0.0007","25.0313","0.0011","40.1189","0.0016","90","","90","","90","","15821","1.2","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","trans-α,α,α',α'-tetra(p-chlorophenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12-dimethanol","","- C48 H37 Cl4 N O2 -","- C48 H37 Cl4 N O2 -","- C768 H592 Cl64 N16 O32 -","16","0.5","","Barton, Benita; Caira, Mino R.; Senekal, Ulrich; Hosten, Eric C.","Complementary host behaviour of three anthracenyl-derived roof-shaped compounds in mixed pyridines","CrystEngComm","2023","25","12","1740","1754","10.1039/D3CE00080J","","","0.71073","MoKα","","0.0971","0.0594","","","0.1615","0.1968","","","","","","1.016","","","","has coordinates,has disorder","282334","2023-04-04","10:16:02",""
"7246371","15.5845","0.0013","24.9973","0.0019","40.03","0.004","90","","90","","90","","15595","2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","none","1,1,1',1'-tetrakis(p-Chlorophenyl)-(9,10-ethanoanthracene-trans-11,12-diyl)dimethanol 2-methylpyridine clathrate'","","- C48 H37 Cl4 N O2 -","- C48 H37 Cl4 N O2 -","- C768 H592 Cl64 N16 O32 -","16","0.5","","Barton, Benita; Caira, Mino R.; Senekal, Ulrich; Hosten, Eric C.","Complementary host behaviour of three anthracenyl-derived roof-shaped compounds in mixed pyridines","CrystEngComm","2023","25","12","1740","1754","10.1039/D3CE00080J","","","0.71073","MoKα","","0.057","0.0515","","","0.1252","0.129","","","","","","1.117","","","","has coordinates","282334","2023-04-04","10:16:02",""
"7246469","6.721","0.0003","19.9988","0.0011","32.6212","0.0019","90","","90","","90","","4384.7","0.4","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C10 H11 I N2 -","- C10 H11 I N2 -","- C160 H176 I16 N32 -","16","0.5","","Chanmungkalakul, Supphachok; Huang, Shiqing; Wu, Xia; Ang, Esther Cai Xia; Yang, Zi-Qi; Li, Yongxin; Yan, Xiaoyu; Tan, Choon-Hong; Tan, Davin; Liu, Xiaogang","Ground-state intramolecular proton transfer inhibits the selective methylation on quinoline and pyridine derivatives.","Physical chemistry chemical physics : PCCP","2023","25","15","10599","10603","10.1039/d3cp00123g","","x-ray","0.71073","MoKα","","0.1133","0.0965","","","0.2711","0.2879","","","","","","1.138","","","","has coordinates,has disorder","283508","2023-05-05","03:35:54",""
"7247407","14.99","0.0002","31.7213","0.0004","46.9852","0.0006","90","","90","","90","","22341.6","0.5","100","0.1","100","0.1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C16 H88 Mo16 N32 Na8 O77 -","- C16 H40 Mo16 N32 Na8 O53 -","- C128 H320 Mo128 N256 Na64 O424 -","8","0.25","","Lin, Rong-Yan; Dai, Ru-Dan; Dong, Xin; Zhou, Zhao-Hui","Hexnuclear, octanuclear, dodecanuclear, and hexadecnuclear polyoxomolybdenum(v)-based porous materials for selective adsorption of gases","CrystEngComm","2023","25","42","5942","5950","10.1039/D3CE00736G","","x-ray","1.54184","CuKα","","0.0461","0.0434","","","0.1331","0.1357","","","","","","1.048","","","","has coordinates","287338","2023-11-06","07:25:02",""
"7247799","19.5933","0.001","22.7256","0.0012","52.888","0.003","90","","90","","90","","23549","2","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C52 H59 N7 Ni2 O23 -","- C52 H37 N7 Ni2 O12 -","- C832 H592 N112 Ni32 O192 -","16","0.5","","Yang, Yuan-Yu; Xue, Jian-Hua; Yang, Dong-Dong; Zhang, Li-Yang; Ma, Qi; Zhao, Xuan","Effects of solvents and metal ions on the synthesis, structural diversity and magnetic properties of the 5′-nitro-[1,1′:3′,1′′-terphenyl]-3,3′′,5,5′′-tetracarboxylic acid ligand and a highly sensitive sensor for Fe3+","CrystEngComm","2024","26","2","170","179","10.1039/D3CE01076G","","","0.71073","MoKα","","0.0492","0.0384","","","0.0843","0.0897","","","","","","1.078","","","","has coordinates","289447","2024-02-04","11:39:07",""
"7248067","36.169","0.003","9.9451","0.0009","13.4069","0.0016","90","","90","","90","","4822.5","0.8","298.15","","298.15","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C12 H12 Cl6 Cu N8 O8 -","- C12 H12 Cl6 Cu N8 O8 -","- C96 H96 Cl48 Cu8 N64 O64 -","8","0.25","","Lu, Zu-Jia; Wang, Ting-Wei; Sun, Mou; Xu, Mei-Qi; Zhang, Chao; Yi, Zhen-Xin; Zhang, Jian-Guo","Synthesis of energetic coordination compounds based on pyrazole and 4-chloropyrazole via co-melting crystallization method","CrystEngComm","2024","26","8","1178","1188","10.1039/D3CE01182H","","","0.71073","MoKα","","0.1081","0.093","","","0.2395","0.2527","","","","","","1.128","","","","has coordinates,has disorder","290142","2024-03-04","20:07:03",""
"7701707","18.5858","0.0008","24.9993","0.001","40.622","0.0017","90","","90","","90","","18874.3","1.4","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C64 H84.4 N48 Ni8 O10.2 -","- C64 H76 N48 Ni8 O10.2 -","- C512 H608 N384 Ni64 O81.6 -","8","0.25","","Abbasi, Parisa; Athanasopoulou, Angeliki A.; Mazarakioti, Eleni C.; Gagnon, Kevin J.; Teat, Simon J.; Escuer, Albert; Pilkington, Melanie; Stamatatos, Theocharis C.","Click chemistry as a route to the synthesis of structurally new and magnetically interesting coordination clusters: a {Ni} complex with a trapezoidal prismatic topology.","Dalton transactions (Cambridge, England : 2003)","2019","48","31","11632","11636","10.1039/c9dt01998g","","","0.7749","synchrotron","","0.1263","0.095","","","0.2535","0.2983","","","","","","1.039","","","","has coordinates,has disorder","223341","2020-10-21","18:00:00",""
"7705073","12.8301","0.0009","16.4771","0.0011","37.538","0.003","90","","90","","90","","7935.6","1","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C32 H28 Cl8 N6 O4 Zn -","- C32 H28 Cl8 N6 O4 Zn -","- C256 H224 Cl64 N48 O32 Zn8 -","8","0.25","","Mo, Xiu-Fang; Xiong, Chang-Feng; Chen, Ze-Wen; Liu, Chao; He, Piao; Tong, Hai-Xia; Yi, Xiao-Yi","Zinc complexes supported by pyridine-<i>N</i>-oxide ligands: synthesis, structures and catalytic Michael addition reactions.","Dalton transactions (Cambridge, England : 2003)","2020","49","35","12365","12371","10.1039/d0dt00185f","","","0.71073","MoKα","","0.1575","0.0783","","","0.1904","0.2155","","","","","","1.147","","","","has coordinates,has disorder","257551","2020-10-21","18:00:00",""
"7705614","16.927","0.003","20.121","0.004","55.331","0.011","90","","90","","90","","18845","6","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C128 H192 B8 F32 N16 Pd4 Si16 -","- C128 H192 B8 F32 N16 Pd4 Si16 -","- C512 H768 B32 F128 N64 Pd16 Si64 -","4","0.125","","Lee, Jeyeong; Lim, Sangwoo; Kim, Dongwon; Jung, Ok-Sang; Lee, Young-A","Flexibility and anion exchange of [(X)@Pd<sub>2</sub>L<sub>4</sub>] cages for recognition of size and charge of polyatomic anions.","Dalton transactions (Cambridge, England : 2003)","2020","49","42","15002","15008","10.1039/d0dt03005h","","","0.8","synchrotron","","0.1583","0.1026","","","0.255","0.2861","","","","","","1.157","","","","has coordinates,has disorder","258803","2020-11-06","12:02:02",""
"7705616","16.586","0.003","19.95","0.004","57.908","0.012","90","","90","","90","","19161","7","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C64 H96 F24 N8 P4 Pd2 Si8 -","- C64 H96 F24 N8 P4 Pd2 Si8 -","- C512 H768 F192 N64 P32 Pd16 Si64 -","8","0.25","","Lee, Jeyeong; Lim, Sangwoo; Kim, Dongwon; Jung, Ok-Sang; Lee, Young-A","Flexibility and anion exchange of [(X)@Pd<sub>2</sub>L<sub>4</sub>] cages for recognition of size and charge of polyatomic anions.","Dalton transactions (Cambridge, England : 2003)","2020","49","42","15002","15008","10.1039/d0dt03005h","","","0.65","synchrotron","","0.0996","0.0949","","","0.2909","0.2974","","","","","","1.131","","","","has coordinates,has disorder","258803","2020-11-06","12:02:03",""
"7707727","18.683","0.005","31.423","0.01","36.377","0.012","90","","90","","90","","21356","11","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C35 H40 Co3 N7 O27 S -","- C35 H40 Co3 N7 O27 S -","- C560 H640 Co48 N112 O432 S16 -","16","0.5","","de Campos, Nathália R; Simosono, Cintia A.; Landre Rosa, Iara M.; da Silva, Rafaela M. R.; Doriguetto, Antônio C; do Pim, Walace D.; Gomes Simões, Tatiana R; Valdo, Ana Karoline S. M.; Martins, Felipe T.; Sarmiento, Charlie V.; Nunes, Wallace C.; Guedes, Guilherme P.; Pedroso, Emerson F.; Pereira, Cynthia L. M.; Stumpf, Humberto O.; Lloret, Francesc; Julve, Miguel; Marinho, Maria Vanda","Building-up host-guest helicate motifs and chains: a magneto-structural study of new field-induced cobalt-based single-ion magnets.","Dalton transactions (Cambridge, England : 2003)","2021","50","31","10707","10728","10.1039/d1dt01693h","","","0.71073","MoKα","","0.1044","0.0671","","","0.2073","0.2324","","","","","","1.08","","","","has coordinates,has disorder","268791","2021-09-06","11:21:31",""
"7709771","34.0893","0.001","39.0572","0.0005","53.629","0.002","90","","90","","90","","71403","4","123","0.1","123","0.1","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C144 H134 F18 N4 O22 P8 Pd4 S6 -","- C144 H134 F18 N4 O22 P8 Pd4 S6 -","- C2304 H2144 F288 N64 O352 P128 Pd64 S96 -","16","0.5","","Ferrer, Montserrat; Gallen, Albert; Martínez, Manuel; Rocamora, Mercè; Puttreddy, Rakesh; Rissanen, Kari","Homo- and and heterometallic chiral dynamic architectures from allyl-palladium(II) building blocks","Dalton Transactions","2022","","","","","10.1039/D1DT03706D","","x-ray","1.54184","CuKα","","0.1775","0.1443","","","0.4136","0.4559","","","","","","1.566","","","","has coordinates,has disorder","273762","2022-03-18","00:02:45",""
"7709772","34.1344","0.0008","39.0265","0.0009","54.2199","0.0015","90","","90","","90","","72229","3","120","0.1","120","0.1","","","","","","","","9","F d d d :2","-F 2uv 2vw","70","","","","- C144 H134 F18 N4 O22 P8 Pd2 Pt2 S6 -","- C144 H134 F18 N4 O22 P8 Pd2 Pt2 S6 -","- C2304 H2144 F288 N64 O352 P128 Pd32 Pt32 S96 -","16","0.5","","Ferrer, Montserrat; Gallen, Albert; Martínez, Manuel; Rocamora, Mercè; Puttreddy, Rakesh; Rissanen, Kari","Homo- and and heterometallic chiral dynamic architectures from allyl-palladium(II) building blocks","Dalton Transactions","2022","","","","","10.1039/D1DT03706D","","x-ray","1.54184","CuKα","","0.1818","0.1537","","","0.4237","0.4682","","","","","","1.602","","","","has coordinates,has disorder","273762","2022-03-18","00:02:45",""
"7710691","13.9584","0.0003","20.1197","0.0004","23.6121","0.0004","90","","90","","90","","6631.2","0.2","122.99","0.1","122.99","0.1","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C13 H28 Cl2 N2 O2 -","- C13 H28 Cl2 N2 O2 -","- C208 H448 Cl32 N32 O32 -","16","0.5","","Kelderman, Cormac; Davey, Patrick; Ma, Michelle; de Veer, Michael; Salimova, Ekaterina; Donnelly, Paul Stephen; Paterson, Brett Michael","Hexadentate Technetium-99m Bis(thiosemicarbazonato) Complexes: Synthesis, Characterisation and Biodistribution","Dalton Transactions","2022","","","","","10.1039/D2DT01264B","","x-ray","1.54184","CuKα","","0.0288","0.0282","","","0.08","0.0805","","","","","","1.058","","","","has coordinates","276713","2022-07-06","22:58:53",""
"7710949","11.4312","0.0013","31.433","0.004","57.919","0.006","90","","90","","90","","20811","4","273","2","273.15","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C25 H22 N4 O7 S Zn -","- C25 H16 N4 O4 S Zn -","- C800 H512 N128 O128 S32 Zn32 -","32","1","","Sinha, Chittaranjan; Bairy, Gurupada; Dey, Arka; Dutta, Basudeb; Maity, Suvendu","Rational synthesis of a pyridyl-imidazoquinazoline based multifunctional 3D Zn(II)-MOF: structure, luminescence, selective and sensitive detection of Al3+ and TNP, and its semiconducting device application","Dalton Transactions","2022","","","","","10.1039/D2DT01790C","","","0.71073","MoKα","","0.0898","0.0623","","","0.1813","0.2169","","","","","","1.1344","","","","has coordinates,has disorder","277227","2022-08-12","22:59:57",""
"7712816","15.108","0.0002","20.4454","0.0004","76.1586","0.0011","90","","90","","90","","23524.6","0.7","120.01","0.1","120.01","0.1","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C73 H111 Mn14 N9 O51 -","- C68 H102 Mn14 N8 O50 -","- C544 H816 Mn112 N64 O400 -","8","0.25","","Brechin, Euan K.; Agapaki, Eleftheria; Canaj, Angelos; Nichol, Gary Stephen","Tetra-, tetradeca- and octadecametallic clusters of Mn","Dalton Transactions","2023","","","","","10.1039/D3DT00732D","","x-ray","0.71073","MoKα","","0.0379","0.0329","","","0.0777","0.0799","","","","","","1.051","","","","has coordinates,has disorder","282710","2023-04-18","23:42:25",""
"7712824","16.251","0.003","35.942","0.006","37.688","0.006","90","","90","","90","","22013","7","300","","300","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C109.42 H70.84 Cl4.84 Ir2 N8 -","- C109.42 H70.84 Cl4.84 Ir2 N8 -","- C875.36 H566.72 Cl38.72 Ir16 N64 -","8","0.25","","Tatarin, Sergei V.; Smirnov, Daniil E.; Taydakov, Ilya V.; Metlin, Mikhail T.; Emets, Victor; Bezzubov, Stanislav","Tailoring the π-system of benzimidazole ligands towards stable light-harvesting cyclometalated iridium(III) complexes","Dalton Transactions","2023","","","","","10.1039/D3DT00200D","","x-ray","0.71073","MoKα","","0.0546","0.0427","","","0.1021","0.1072","","","","","","1.071","","","","has coordinates,has disorder","282754","2023-04-19","23:53:14",""
"7713198","12.4412","0.0011","17.6466","0.0016","37.201","0.004","90","","90","","90","","8167.3","1.4","299","2","299.37","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Al F6 Rb3 -","- Al F6 Rb3 -","- Al48 F288 Rb144 -","48","1.5","","Morrison, Gregory; Masachchi, Lakshani W.; Tisdale, Hunter B.; Chang, Tieyan; Jones, Virginia G.; Zamorano, K. Pilar; Breton, Logan S.; Smith, Mark D.; Chen, Yu-Sheng; Zur Loye, Hans-Conrad","Polymorphism in A3MF6 (A = Rb, Cs; M = Al, Ga) Grown using Mixed Halide Fluxes","Dalton Transactions","2023","","","","","10.1039/D3DT00352C","","","0.71073","MoKα","","0.0306","0.0252","","","0.0612","0.0643","","","","","","1.069","","","","has coordinates","284075","2023-05-30","22:56:18",""
"7713200","13.0311","0.0006","18.4837","0.0009","39.024","0.0018","90","","90","","90","","9399.4","0.8","300","2","300.09","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Al Cs3 F6 -","- Al Cs3 F6 -","- Al48 Cs144 F288 -","48","1.5","","Morrison, Gregory; Masachchi, Lakshani W.; Tisdale, Hunter B.; Chang, Tieyan; Jones, Virginia G.; Zamorano, K. Pilar; Breton, Logan S.; Smith, Mark D.; Chen, Yu-Sheng; Zur Loye, Hans-Conrad","Polymorphism in A3MF6 (A = Rb, Cs; M = Al, Ga) Grown using Mixed Halide Fluxes","Dalton Transactions","2023","","","","","10.1039/D3DT00352C","","","0.71073","MoKα","","0.0289","0.0255","","","0.0542","0.0565","","","","","","1.122","","","","has coordinates","284075","2023-05-30","22:56:18",""
"7713201","13.1762","0.0008","18.7515","0.0012","39.488","0.003","90","","90","","90","","9756.4","1.1","299","2","299.26","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cs3 F6 Ga -","- Cs3 F6 Ga -","- Cs144 F288 Ga48 -","48","1.5","","Morrison, Gregory; Masachchi, Lakshani W.; Tisdale, Hunter B.; Chang, Tieyan; Jones, Virginia G.; Zamorano, K. Pilar; Breton, Logan S.; Smith, Mark D.; Chen, Yu-Sheng; Zur Loye, Hans-Conrad","Polymorphism in A3MF6 (A = Rb, Cs; M = Al, Ga) Grown using Mixed Halide Fluxes","Dalton Transactions","2023","","","","","10.1039/D3DT00352C","","","0.71073","MoKα","","0.032","0.0264","","","0.0587","0.0626","","","","","","1.104","","","","has coordinates","284075","2023-05-30","22:56:18",""
"7713985","21.7708","0.0017","22.4926","0.0019","24.322","0.002","90","","90","","90","","11910","1.7","150","","150","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C15 H20 Br0.5 Co0.5 N P -","- C15 H20 Br0.5 Co0.5 N P -","- C480 H640 Br16 Co16 N32 P32 -","32","1","","SCHILTZ, pauline; Casaretto, Nicolas; Bourcier, Sophie; Gosmini, Corinne; Auffrant, Audrey","Phosphinoquinoline supported CoII, NiII, and FeII complexes: divergent behaviour upon reduction","Dalton Transactions","2023","","","","","10.1039/D3DT02441E","","","0.71073","MoKα","","0.0571","0.0322","","","0.0643","0.075","","","","","","1.011","","","","has coordinates","286420","2023-09-19","22:53:16",""
"7714844","16.7299","0.0004","38.8794","0.0011","49.0089","0.0012","90","","90","","90","","31877.8","1.4","173","","173","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C64 H104 N6 P4 Ru2 -","- C64 H104 N6 P4 Ru2 -","- C1024 H1664 N96 P64 Ru32 -","16","0.5","","Donnelly, Laurie J.; Lin, Jian-Bin; Gelfand, Benjamin S.; Chang, Chia Yun; Piers, Warren E.","Ruthenium polyhydrides supported by rigid PCP pincer ligands: dynamic behaviour and reactions with CO<sub>2</sub>.","Dalton transactions (Cambridge, England : 2003)","2024","53","4","1862","1869","10.1039/d3dt04014c","","x-ray","1.54178","CuKα","","0.1","0.0835","","","0.1954","0.2067","","","","","","1.155","","","","has coordinates,has disorder","289496","2024-02-04","11:55:29",""
"7715458","17.865","0.004","18.094","0.004","27.261","0.008","90","","90","","90","","8812","4","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H13 N3 O8 Pr -","- C16 H13 N3 O8 Pr -","- C256 H208 N48 O128 Pr16 -","16","0.5","","Khan, Mohammad Yasir; Husain, Ahmad; Mahajan, Dhiraj K.; Muaz, Mohammad; Shahid, M.; Zeeshan, Mohd; Sama, Farasha; Ahmad, Sharique","Facile synthesis of a three-dimensional Ln-MOF@FCNT composite for the fabrication of a symmetric supercapacitor device with ultra-high energy density: overcoming the energy storage barrier.","Dalton transactions (Cambridge, England : 2003)","2024","53","17","7477","7497","10.1039/d4dt00136b","","","0.71073","MoKα","","0.0457","0.0322","","","0.0821","0.1","","","","","","1.1315","","","","has coordinates","291615","2024-05-05","02:42:39",""
"7715613","13.0663","0.0016","17.1914","0.0018","29.81","0.007","90","","90","","90","","6696.2","1.9","150","0.1","150.15","","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C30 H30 B2 Co F8 N12 O2 -","- C30 H30 B2 Co F8 N12 O2 -","- C240 H240 B16 Co8 F64 N96 O16 -","8","0.25","","Brook, David J. R.; DaRos, Jeffrey; Ponnekanti, Aamani; Agrestini, Stefano; Pellegrin, Eric","Spectroscopic and thermodynamic characterization of a cobalt-verdazyl valence tautomeric system. influence of crystal structure, solvent and counterion.","Dalton transactions (Cambridge, England : 2003)","2024","53","17","7536","7545","10.1039/d4dt00465e","","","0.71073","MoKα","","0.1098","0.0844","","","0.1887","0.2027","","","","","","1.072","","","","has coordinates,has disorder","291602","2024-05-05","02:32:59",""
"7715614","13.1032","0.0008","17.2017","0.001","30.254","0.002","90","","90","","90","","6819.2","0.7","250","0.7","250","0.7","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C30 H30 B2 Co F8 N12 O2 -","- C30 H30 B2 Co F8 N12 O2 -","- C240 H240 B16 Co8 F64 N96 O16 -","8","0.25","","Brook, David J. R.; DaRos, Jeffrey; Ponnekanti, Aamani; Agrestini, Stefano; Pellegrin, Eric","Spectroscopic and thermodynamic characterization of a cobalt-verdazyl valence tautomeric system. influence of crystal structure, solvent and counterion.","Dalton transactions (Cambridge, England : 2003)","2024","53","17","7536","7545","10.1039/d4dt00465e","","x-ray","0.71073","MoKα","","0.1363","0.0844","","","0.1751","0.1964","","","","","","1.109","","","","has coordinates,has disorder","291602","2024-05-05","02:33:00",""
"8000554","13.8229","0.001","25.6413","0.0019","28.239","0.002","90","","90","","90","","10008.9","1.3","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C46 H44 Co N14 O14 Yb -","- C46 H44 Co N14 O14 Yb -","- C368 H352 Co8 N112 O112 Yb8 -","8","0.25","","Zakrzewski, Jakub J.; Kumar, Kunal; Zychowicz, Mikolaj; Jankowski, Robert; Wyczesany, Maciej; Sieklucka, Barbara; Ohkoshi, Shin-Ichi; Chorazy, Szymon","Combined Experimental and Ab Initio Methods for Rationalization of Magneto-Luminescent Properties of Yb<sup>III</sup> Nanomagnets Embedded in Cyanido/Thiocyanidometallate-Based Crystals.","The journal of physical chemistry letters","2021","","","10558","10566","10.1021/acs.jpclett.1c02942","","x-ray","0.71073","MoKα","","0.0318","0.0235","","","0.0484","0.0506","","","","","","1.063","","","","has coordinates,has disorder","270298","2021-11-04","02:02:26",""
"8000555","13.8789","0.0014","25.716","0.003","28.221","0.003","90","","90","","90","","10072.4","1.9","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C46 H44 Ir N14 O14 Yb -","- C46 H44 Ir N14 O14 Yb -","- C368 H352 Ir8 N112 O112 Yb8 -","8","0.25","","Zakrzewski, Jakub J.; Kumar, Kunal; Zychowicz, Mikolaj; Jankowski, Robert; Wyczesany, Maciej; Sieklucka, Barbara; Ohkoshi, Shin-Ichi; Chorazy, Szymon","Combined Experimental and Ab Initio Methods for Rationalization of Magneto-Luminescent Properties of Yb<sup>III</sup> Nanomagnets Embedded in Cyanido/Thiocyanidometallate-Based Crystals.","The journal of physical chemistry letters","2021","","","10558","10566","10.1021/acs.jpclett.1c02942","","x-ray","0.71073","MoKα","","0.0862","0.0703","","","0.1238","0.1303","","","","","","1.134","","","","has coordinates,has disorder","270298","2021-11-04","02:02:26",""
"8000556","13.826","0.0007","25.726","0.0012","28.263","0.0013","90","","90","","90","","10052.8","0.8","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C46 H44 Fe N14 O14 Yb -","- C46 H44 Fe N14 O14 Yb -","- C368 H352 Fe8 N112 O112 Yb8 -","8","0.25","","Zakrzewski, Jakub J.; Kumar, Kunal; Zychowicz, Mikolaj; Jankowski, Robert; Wyczesany, Maciej; Sieklucka, Barbara; Ohkoshi, Shin-Ichi; Chorazy, Szymon","Combined Experimental and Ab Initio Methods for Rationalization of Magneto-Luminescent Properties of Yb<sup>III</sup> Nanomagnets Embedded in Cyanido/Thiocyanidometallate-Based Crystals.","The journal of physical chemistry letters","2021","","","10558","10566","10.1021/acs.jpclett.1c02942","","x-ray","0.71073","MoKα","","0.0308","0.0248","","","0.05","0.0516","","","","","","1.071","","","","has coordinates,has disorder","270298","2021-11-04","02:02:27",""
"8000557","13.9366","0.0011","25.744","0.002","28.199","0.003","90","","90","","90","","10117.3","1.6","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C46 H32 Cr N14 O14 Yb -","- C46 H32 Cr N14 O14 Yb -","- C368 H256 Cr8 N112 O112 Yb8 -","8","0.25","","Zakrzewski, Jakub J.; Kumar, Kunal; Zychowicz, Mikolaj; Jankowski, Robert; Wyczesany, Maciej; Sieklucka, Barbara; Ohkoshi, Shin-Ichi; Chorazy, Szymon","Combined Experimental and Ab Initio Methods for Rationalization of Magneto-Luminescent Properties of Yb<sup>III</sup> Nanomagnets Embedded in Cyanido/Thiocyanidometallate-Based Crystals.","The journal of physical chemistry letters","2021","","","10558","10566","10.1021/acs.jpclett.1c02942","","x-ray","0.71073","MoKα","","0.0696","0.0529","","","0.1145","0.1212","","","","","","1.036","","","","has coordinates,has disorder","270298","2021-11-04","02:02:27",""
"8101199","15.602","0.002","21.668","0.002","45.865","0.006","90","","90","","90","","15505","3","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C12 H18 Cl6 N6 Na Ta -","- C12 H18 Cl6 N6 Na Ta -","- C288 H432 Cl144 N144 Na24 Ta24 -","24","0.75","","Müller, Ulrich; Noll, Andrea","Crystal structure of hexakis(acetonitrile)sodium hexachlorotantalate(V), [Na(NCCH~3~)~6~][TaCl~6~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","1","191","192","10.1515/ncrs-2000-0194","","","","","","","","","","","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101305","10.873","0.001","11.993","0.001","17.937","0.002","90","","90","","90","","2339","0.4","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","Dibarium calcium tetranitridotungstate(VI)","","","- Ba2 Ca N4 W -","- Ba2 Ca N4 W -","- Ba32 Ca16 N64 W16 -","16","0.5","","Höhn, Peter; Kniep, Rüdiger","Crystal structure of dibarium calcium [tetranitridotungstate(VI)], Ba~2~Ca[WN~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","331","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101844","8.686","0.003","15.568","0.005","36.521","0.011","90","","90","","90","","4939","3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Crystal structure of poly-[{bis(cyanide-C)iron(II)}tetra(μ~2~cyanide-C:N)- bis{bis(ethylenediamine-N,N)cadmium(II)}], Cd~2~Fe(CN)~6~(C~2~H~8~N~2~)~4~","","- C14 H32 Cd2 Fe N14 -","- C14 H32 Cd2 Fe N14 -","- C112 H256 Cd16 Fe8 N112 -","8","0.25","","A.-Y. Fu; D.-Q. Wang","Crystal structure of poly[{bis(cyanide-C)iron(II)}tetra(μ^2 ^-cyanide-C:N)bis{bis(ethylenediamine-N,N')cadmium(II)}], Cd~2~Fe (CN)~6~(C~2~H~8~N~2~)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","501","502","","","","0.71073","MoKα","","0.0371","0.0269","","","0.0605","0.0646","","","","","","1.005","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102028","3.6677","0.0011","30.046","0.009","38.877","0.012","90","","90","","90","","4284","2","273","2","273","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","bis(1,10-phenanthroline-N,N')silver(I) mononitrate","","- C24 H16 Ag N5 O3 -","- C24 H16 Ag N5 O3 -","- C192 H128 Ag8 N40 O24 -","8","0.25","","Li, P.-G.; Wang, Q.-L.; Li, D.-S.; Fu, F.; Qi, G.-C.","Crystal structure of bis(1,10-phenanthroline-N,N')silver(I) mononitrate, [Ag(C~12~H~8~N~2~)~2~][NO~3~]","Zeitschrift für Kristallographie - New Crystal Structures","2006","221","3","391","392","","","","0.71073","MoKα","","0.1355","0.0638","","","0.1661","0.1975","","","","","","0.849","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103036","12.1639","0.0004","20.1013","0.0007","59.798","0.002","90","","90","","90","","14621.2","0.9","296","2","296","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Mn11 O22 Rb15 -","- Mn11 O22 Rb15 -","- Mn176 O352 Rb240 -","16","0.5","","Steffen Pfeiffer; Jürgen Nuss; Martin Jansen","Crystal structure of rubidium oxomanganate, Rb15Mn11O22","Zeitschrift für Kristallographie - New Crystal Structures","2009","224","3","377","","","","x-ray","0.71073","MoKα","","0.2083","0.0547","","","0.1535","0.2349","","","","","","0.988","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103395","4.868","","24.999","","25.727","","90","","90","","90","","3130.85","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ag Te I","","- Ag I Te -","- Ag0.992 I Te -","- Ag31.744 I32 Te32 -","32","1","","Boettcher, P.; Schnieders, F.","Darstellung und Kristallstruktur von Ag Te I","Zeitschrift fuer Kristallographie (149,1979-)","1995","210","","323","327","10.1524/zkri.1995.210.5.323","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103399","6.085","","13.92","","24.33","","90","","90","","90","","2060.83","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 Ag (Nb Se4)","","- Ag Nb Rb2 Se4 -","- Ag Nb Rb2 Se4 -","- Ag8 Nb8 Rb16 Se32 -","8","0.25","","Bensch, W.; Weidlich, C.; Duerichen, P.","Crystal structure of dirubidium silver niobium tetrasulfide, Rb2 Ag Nb S4","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","932","932","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103403","5.83","","12.68","","10.27","","90","","90","","90","","759.204","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ag2 (S O4)","","- Ag2 O4 S -","- Ag2 O4 S -","- Ag16 O32 S8 -","8","0.25","","Zachariasen, W.H.","Note on the crystal structure of silver sulphate, Ag2 S O4","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","82","","161","162","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103944","5.585","","13.132","","23.126","","90","","90","","90","","1696.11","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K2 Cu (Nb S4)","","- Cu K2 Nb S4 -","- Cu K2 Nb S4 -","- Cu8 K16 Nb8 S32 -","8","0.25","","Bensch, W.; Duerichen, P.; Weidlich, C.","Crystal structure of dipotassium copper niobium tetrasulfide, K2 Cu Nb S4","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","931","931","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104276","16.78","","11.87","","16.8","","90","","90","","90","","3346.2","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Ca3 (Al1.6 Fe0.4) (Si O4)3","","- Al1.6 Ca3 Fe0.4 O12 Si3 -","- Al1.6 Ca3 Fe0.4 O12 Si3 -","- Al25.6 Ca48 Fe6.4 O192 Si48 -","16","0.5","","Takeuchi, Y.; Haga, N.; Umizu, S.; Sato, G.","The derivate structure of silicate garnets in Grandite","Zeitschrift fuer Kristallographie (149,1979-)","1982","158","","53","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","167960","2020-10-21","18:00:00",""
"8104277","16.839","","11.923","","16.875","","90","","90","","90","","3388.02","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Ca3 (Al1.332 Fe0.668) (Si O4)3","","- Al1.332 Ca3 Fe0.668 O12 Si3 -","- Al1.332 Ca3 Fe0.668 O12 Si3 -","- Al21.312 Ca48 Fe10.688 O192 Si48 -","16","0.5","","Takeuchi, Y.; Haga, N.; Umizu, S.; Sato, G.","The derivate structure of silicate garnets in Grandite","Zeitschrift fuer Kristallographie (149,1979-)","1982","158","","53","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","167962","2020-10-21","18:00:00",""
"8104278","16.911","","11.963","","16.931","","90","","90","","90","","3425.25","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Ca3 (Al0.84 Fe1.16) (Si O4)3","","- Al0.84 Ca3 Fe1.16 O12 Si3 -","- Al0.84 Ca3 Fe1.16 O12 Si3 -","- Al13.44 Ca48 Fe18.56 O192 Si48 -","16","0.5","","Takeuchi, Y.; Haga, N.; Umizu, S.; Sato, G.","The derivate structure of silicate garnets in grandite","Zeitschrift fuer Kristallographie (149,1979-)","1982","158","","53","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","167964","2020-10-21","18:00:00",""
"8104369","20.901","","21.12","","13.02","","90","","90","","90","","5747.41","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Sr In2 S4","","- In2 S4 Sr -","- In2 S4 Sr -","- In64 S128 Sr32 -","32","1","","Eisenmann, B.; Hofmann, A.","Crystal structure of strontium phyllo-tetrathioindate(III)","Zeitschrift fuer Kristallographie (149,1979-)","1991","197","","167","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8107456","10.116","0.002","13.532","0.003","23.507","0.005","90","","90","","90","","3217.9","1.2","100.5","","100.5","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C8 H28 Cl2 Co N4 O2 -","- C8 H28 Cl2 Co N4 O2 -","- C64 H224 Cl16 Co8 N32 O16 -","8","0.25","","Jiehye, Shin; Jaeun, Kang; Do, Junghwan","Crystal structure of poly[diaqua-bis(μ 2-1,4-diaminobutane-N:N′)cobalt(II)] dichloride, C8H28Cl2CoN4O2","Zeitschrift für Kristallographie - New Crystal Structures","2023","238","3","413","415","10.1515/ncrs-2022-0227","","","0.60997","synchrotron","","0.0387","0.0361","","","0.1052","0.1069","","","","","","1.151","","","","has coordinates","285122","2023-07-10","09:24:57",""
"9000147","8.546","","11.222","","21.158","","90","","90","","90","","2029.12","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","Fluellite","- Al2 F2 H17.24 O12 P -","- Al2 F2 H17.24 O12 P -","- Al16 F16 H137.92 O96 P8 -","8","0.25","","Guy, B. B.; Jeffrey, G. A.","The crystal structure of fluellite, Al2PO4F2(OH).7H2O","American Mineralogist","1966","51","","1579","1592","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9002635","11.959","","16.958","","16.958","","90","","90","","90","","3439.09","","","","","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","Uvarovite","- Al0.577 Ca3 Cr1.423 O12 Si3 -","- Al0.577 Ca3 Cr1.423 O12 Si3 -","- Al9.232 Ca48 Cr22.768 O192 Si48 -","16","0.5","","Wildner, M.; Andrut, M.","The crystal chemistry of birefringent natural uvarovites: Part II. Single-crystal X-ray structures Sample: Sar-899","American Mineralogist","2001","86","","1231","1251","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9004092","9.829","","12.302","","5.868","","90","","90","","90","","709.537","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","Thenardite","- Na2 O4 S -","- Na2 O4 S -","- Na16 O32 S8 -","8","0.25","","Hawthorne, F. C.; Ferguson, R. B.","Anhydrous sulphates. I: Refinement of the crystal structure of celestite with an appendix on the structure of thenardite","The Canadian Mineralogist","1975","13","","181","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004694","7.4691","","9.5969","","9.7","","90","","90","","90","","695.298","","","","","","","","","","","","Synthetic","3","F d d d :2","-F 2uv 2vw","70","","","Melanothallite","- Cl2 Cu2 O -","- Cl2 Cu2 O -","- Cl16 Cu16 O8 -","8","0.25","","Krivovichev, S. V.; Filatov, S. K.; Burns, P. C.","The cuprite-like framework of OCu4 tetrahedra in the crystal structure of synthetic melanothallite, Cu2OCl2, and its negative thermal expansion","The Canadian Mineralogist","2002","40","","1185","1190","10.2113/gscanmin.40.4.1185","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9006276","5.702","","11.169","","9.593","","90","","90","","90","","610.936","","","","","","","","","","quenched from 37 kbar and 1600 deg C","quenched from 37 kbar","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Dollase, W. A.; Seifert, F.; O'Neill H St C","Structure of Cr2SiO4 and possible metal-metal interactions in crystal and melt Sample: P3A, quenched from 37 kbar and 1600 deg C","Physics and Chemistry of Minerals","1994","21","","104","109","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006640","5.7005","","11.1651","","9.5847","","90","","90","","90","","610.034","","","","","","","","100","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample in air: P = 0.0001 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006641","5.7007","","11.1653","","9.585","","90","","90","","90","","610.085","","","","","","","","100","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample in diamond anvil cell: P = 0.0001 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006642","5.6804","","11.1174","","9.3842","","90","","90","","90","","592.624","","","","","","","","3106000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 3.106 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006643","5.665","","11.0863","","9.2742","","90","","90","","90","","582.456","","","","","","","","5303000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 5.303 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006644","5.6512","","11.0598","","9.191","","90","","90","","90","","574.448","","","","","","","","7300000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 7.300 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006645","5.6374","","11.0375","","9.1192","","90","","90","","90","","567.422","","","","","","","","9220000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 9.220 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007838","6.867","","12.345","","27.527","","90","","90","","90","","2333.55","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Na1.333 O7 P2 Zr0.667 -","- Na1.33334 O7 P2 Zr0.66666 -","- Na21.3334 O112 P32 Zr10.6666 -","16","0.5","","Gali, S.; Byrappa, K.","Structure of (Na2/3Zr1/3)P2O7","Acta Crystallographica, Section C","1990","46","","2011","2013","10.1107/S0108270190001263","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007884","8.334","","11.212","","18.668","","90","","90","","90","","1744.35","","","","","","","","","","","","Democratic Republic of the Congo","4","F d d d :2","-F 2uv 2vw","70","","","Soddyite","- H4 O10 Si U2 -","- H4 O10 Si U2 -","- H32 O80 Si8 U16 -","8","0.25","","Demartin, F.; Gramaccioli, C. M.; Pilati, T.","The importance of accurate crystal structure determination of uranium minerals. II. Soddyite (UO2)2(SiO4)*2H2O","Acta Crystallographica, Section C","1992","48","","1","4","10.1107/S0108270191004481","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:47",""
"9007953","8.0183","","11.272","","23.961","","90","","90","","90","","2165.65","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Se3 Yb2 -","- Se3 Yb2 -","- Se48 Yb32 -","16","0.5","","Assoud, A.; Kleinke, H.","Ytterbium sesquiselenide Yb2Se3","Acta Crystallographica, Section E","2003","59","","i103","i104","10.1107/S1600536803013242","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008008","8.2223","","11.6292","","24.6085","","90","","90","","90","","2353.03","","298","2","298","2","","","","","","","Synthetic","2","F d d d :2","-F 2uv 2vw","70","Scandium sesquitelluride","Discandium tritelluride","","- Sc2 Te3 -","- Sc2 Te3 -","- Sc32 Te48 -","16","0.5","WM6121","Assoud, A.; Kleinke, H.","The sesquitelluride Sc~2~Te~3~","Acta Crystallographica Section E","2006","62","1","i17","i18","10.1107/S1600536805041747","","","0.71073","MoKα","","0.0352","0.0308","","","0.0852","0.0891","","","","","","1.409","","","","has coordinates","282068","2023-03-26","10:21:06",""
"9008577","10.467","","12.87","","24.493","","90","","90","","90","","3299.46","","","","","","","","","","","","","1","F d d d :2","-F 2uv 2vw","70","Sulphur","","Sulphur","- S8 -","- S8 -","- S128 -","16","0.5","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York","Crystal Structures","1963","1","","7","83","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:59",""
"9011362","10.4646","","12.866","","24.486","","90","","90","","90","","3296.74","","","","298","","","","","","","","","1","F d d d :2","-F 2uv 2vw","70","","","Sulfur","- S8 -","- S8 -","- S128 -","16","0.5","","Rettig, S. J.; Trotter, J.","Refinement of the structure of orthorhombic sulfur, alpha-S8 Locality: synthetic Sample: at T = 298 K Note: alpha phase","Acta Crystallographica, Section C","1987","43","","2260","2262","10.1107/S0108270187088152","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011363","10.4646","","12.866","","24.486","","90","","90","","90","","3296.74","","","","298","","","","","","","","","1","F d d d :2","-F 2uv 2vw","70","","","Sulfur","- S8 -","- S8 -","- S128 -","16","0.5","","Rettig, S. J.; Trotter, J.","Refinement of the structure of orthorhombic sulfur, alpha-S8 Locality: synthetic Sample: at T = 298 K Note: alpha phase Note: coordinate positions of atoms correspond to high-angle refinements","Acta Crystallographica, Section C","1987","43","","2260","2262","10.1107/S0108270187088152","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9012743","14.243","","13.045","","33.4839","","90","","90","","90","","6221.31","","","","","","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","Odintsovite","- Be4 Ca3 K2 Li0.25 Na3.75 O38 Si12 Ti2 -","- Be4 Ca3 K2 Li0.25 Na3.75 O38 Si12 Ti2 -","- Be32 Ca24 K16 Li2 Na30 O304 Si96 Ti16 -","8","0.25","","Rastsvetaeva, R. K.; Evsyunin, V. G.; Kashaev, A. A.","Crystal structure of a new representative of ring silicates","Doklady Chemistry","1995","340","","49","51","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9017065","24.764","","24.862","","8.1995","","90","","90","","90","","5048.29","","","","230","","","","","","","","Synthetic","3","F d d d :2","-F 2uv 2vw","70","","","","- Li9 Mn18 O36 -","- Li72 Mn144 O288 -","- Li72 Mn144 O288 -","","","","Ishizawa, N.; Tateishi, K.; Oishi, S.; Kishimoto, S.","Bond-length fluctuation in the orthorhombic 3x3x1 superstructure of LiMn2O4 Note: T = 230 K","American Mineralogist","2014","99","","1528","1536","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:18",""