# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-24T13:57:28+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Dalton Transactions') AND volume = 39 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
"7024344","25.23","0.009","11.985","0.004","27.967","0.01","90","","103.532","0.007","90","","8222","5","123","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C67 H78 Co4 F6 N24 O15 S2 -","- C62 H56 Co4 F6 N24 O10 S2 -","- C248 H224 Co16 F24 N96 O40 S8 -","4","0.5","","Shuvaev, Konstantin V.; Dawe, Louise N.; Thompson, Laurence K.","Formation of unusual molecular rectangles and squares containing low spin and high spin Co(ii) and Fe(ii) centers","Dalton Transactions","2010","39","20","4768","","10.1039/b915595c","","","0.71075","MoKα","","0.0756","0.0679","","","0.1853","0.1931","","","","","","1.105","","","","has coordinates","179948","2020-10-21","18:00:00",""
"7024345","11.95","0.003","27.769","0.006","13.903","0.003","90","","103.404","0.005","90","","4487.9","1.8","123","2","123","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C62 H84 Co4 F6 N24 O19 S6 -","- C61 H56 Co4 F3 N24 O3 S5 -","- C122 H112 Co8 F6 N48 O6 S10 -","2","0.5","","Shuvaev, Konstantin V.; Dawe, Louise N.; Thompson, Laurence K.","Formation of unusual molecular rectangles and squares containing low spin and high spin Co(ii) and Fe(ii) centers","Dalton Transactions","2010","39","20","4768","","10.1039/b915595c","","","0.71075","MoKα","","0.094","0.0692","","","0.1877","0.2044","","","","","","0.993","","","","has coordinates","179948","2020-10-21","18:00:00",""
"7024346","13.767","0.002","14.043","0.003","21.488","0.004","89.44","0.007","80.884","0.005","89.425","0.007","4101.5","1.3","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C66 H64 F12 Fe4 N24 O18 S4 -","- C66 H62 F12 Fe4 N24 O18 S4 -","- C132 H124 F24 Fe8 N48 O36 S8 -","2","1","","Shuvaev, Konstantin V.; Dawe, Louise N.; Thompson, Laurence K.","Formation of unusual molecular rectangles and squares containing low spin and high spin Co(ii) and Fe(ii) centers","Dalton Transactions","2010","39","20","4768","","10.1039/b915595c","","","0.71075","MoKα","","0.131","0.1177","","","0.3177","0.3323","","","","","","1.071","","","","has coordinates,has disorder","179948","2020-10-21","18:00:00",""
"7024347","29.487","0.009","18.419","0.005","14.466","0.005","90","","109.027","0.005","90","","7428","4","133","2","133","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H62 F6 Fe4 N24 O8 S6 -","- C62 H56 F6 Fe4 N24 O8 S6 -","- C248 H224 F24 Fe16 N96 O32 S24 -","4","0.5","","Shuvaev, Konstantin V.; Dawe, Louise N.; Thompson, Laurence K.","Formation of unusual molecular rectangles and squares containing low spin and high spin Co(ii) and Fe(ii) centers","Dalton Transactions","2010","39","20","4768","","10.1039/b915595c","","","0.71075","MoKα","","0.1081","0.105","","","0.2767","0.2798","","","","","","1.045","","","","has coordinates,has disorder","179948","2020-10-21","18:00:00",""
"7024348","11.95","0.003","27.769","0.006","13.903","0.003","90","","103.404","0.005","90","","4487.9","1.8","123","2","123","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C62 H69.6 Co4 F6 N24 O11.8 S6 -","- C62 H56 Co4 F6 N24 O11.8 S6 -","- C124 H112 Co8 F12 N48 O23.6 S12 -","2","0.5","","Shuvaev, Konstantin V.; Dawe, Louise N.; Thompson, Laurence K.","Formation of unusual molecular rectangles and squares containing low spin and high spin Co(ii) and Fe(ii) centers","Dalton Transactions","2010","39","20","4768","","10.1039/b915595c","","","0.71075","MoKα","","0.1368","0.1125","","","0.3015","0.3221","","","","","","1.169","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7024410","16.71","0.002","18.689","0.002","12.537","0.002","90","","108.425","0.002","90","","3714.5","0.8","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H105 Co2 N5 O8 -","- C81 H100 Co2 N5 O8 -","- C162 H200 Co4 N10 O16 -","2","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","1.54184","CuKα","","0.0744","0.0514","","","0.1346","0.1426","","","","","","1.04","","","","has coordinates","179949","2020-10-21","18:00:00",""
"7024411","16.759","0.002","18.788","0.002","12.57","0.001","90","","108.273","0.001","90","","3758.3","0.7","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H105 Co2 N5 O8 -","- C81 H100 Co2 N5 O8 -","- C162 H200 Co4 N10 O16 -","2","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","1.54184","CuKα","","0.0711","0.0483","","","0.1289","0.1364","","","","","","0.95","","","","has coordinates,has disorder","179949","2020-10-21","18:00:00",""
"7024412","16.817","0.005","18.941","0.005","12.596","0.005","90","","107.818","0.004","90","","3820","2","250","2","250","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H105 Co2 N5 O8 -","- C81 H100 Co2 N5 O8 -","- C162 H200 Co4 N10 O16 -","2","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","1.54184","CuKα","","0.1","0.0709","","","0.1784","0.1891","","","","","","1.096","","","","has coordinates,has disorder","179949","2020-10-21","18:00:00",""
"7024413","16.829","0.004","19.017","0.003","12.603","0.002","90","","107.581","0.002","90","","3845","1.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H105 Co2 N5 O8 -","- C81 H100 Co2 N5 O8 -","- C162 H200 Co4 N10 O16 -","2","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","1.54184","CuKα","","0.108","0.0765","","","0.1756","0.1843","","","","","","1.242","","","","has coordinates,has disorder","179949","2020-10-21","18:00:00",""
"7024414","16.836","0.004","19.038","0.006","12.611","0.004","90","","107.49","0.003","90","","3855","2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H105 Co2 N5 O8 -","- C81 H100 Co2 N5 O8 -","- C162 H200 Co4 N10 O16 -","2","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","1.54184","CuKα","","0.1005","0.0673","","","0.1652","0.175","","","","","","1.135","","","","has coordinates,has disorder","179949","2020-10-21","18:00:00",""
"7024415","32.181","0.005","8.875","0.002","18.171","0.003","90","","119.949","0.005","90","","4496.8","1.5","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H62 Co N6 O4 -","- C46 H62 Co N6 O4 -","- C184 H248 Co4 N24 O16 -","4","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","0.71073","MoKα","","0.1208","0.0586","","","0.1001","0.1162","","","","","","0.786","","","","has coordinates","179949","2020-10-21","18:00:00",""
"7024416","20.456","0.007","15.477","0.005","23.064","0.007","90","","106.183","0.004","90","","7013","4","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C144 H220 Co3 N6 O12 -","- C144 H220 Co3 N6 O12 -","- C288 H440 Co6 N12 O24 -","2","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","1.54184","CuKα","","0.1237","0.0637","","","0.1528","0.1703","","","","","","0.905","","","","has coordinates,has disorder","179949","2020-10-21","18:00:00",""
"7024417","20.72","0.004","15.66","0.003","22.57","0.005","90","","105.97","0.03","90","","7041","3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C144 H220 Co3 N6 O12 -","- C114 H150 Co3 N6 O12 -","- C228 H300 Co6 N12 O24 -","2","0.5","","Mulyana, Yanyan; Poneti, Giordano; Moubaraki, Boujemaa; Murray, Keith S.; Abrahams, Brendan F.; Sorace, Lorenzo; Boskovic, Colette","Solvation effects on the valence tautomeric transition of a cobalt complex in the solid state","Dalton Transactions","2010","39","20","4757","","10.1039/b916749h","","","0.73444","synchrotronradiation","","0.0728","0.0588","","","0.1626","0.1717","","","","","","1.063","","","","has coordinates,has disorder","179949","2020-10-21","18:00:00",""
"7024631","12.042","0.0013","16.2062","0.0018","16.7613","0.0018","87.338","0.002","69.454","0.002","71.207","0.002","2891.5","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C102 H124 Cl6 Mn4 N10 Ni6 O34 -","- C102 H124 Cl6 Mn4 N10 Ni6 O34 -","- C102 H124 Cl6 Mn4 N10 Ni6 O34 -","1","0.5","","Nayak, Sanjit; Aromí, Guillem; Teat, Simon J.; Ribas-Ariño, Jordi; Gamez, Patrick; Reedijk, Jan","Hydrogen bond assisted co-crystallization of a bimetallic MnIII2NiII2 cluster and a NiII2 cluster unit: synthesis, structure, spectroscopy and magnetism","Dalton Transactions","2010","39","20","4986","","10.1039/b919654d","","","0.7749","synchrotron","","0.0714","0.0435","","","0.0989","0.1086","","","","","","1.022","","","","has coordinates,has disorder","179951","2020-10-21","18:00:00",""
"7024978","8.45","0.0006","11.6495","0.0009","12.9271","0.0008","109.719","0.004","90.305","0.005","98.638","0.003","1182.17","0.15","173","2","173","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C27 H35 N2 P -","- C27 H35 N2 P -","- C54 H70 N4 P2 -","2","1","","Seacome, Richard J.; Coles, Martyn P.; Glover, Jean E.; Hitchcock, Peter B.; Rowlands, Gareth J.","Planar-chiral imidazole-based phosphine ligands derived from [2.2]paracyclophane","Dalton Transactions","2010","39","15","3687","","10.1039/b923716j","","x-ray","0.71073","MoKα","","0.0966","0.0597","","","0.1221","0.1398","","","","","","1.039","","","","has coordinates","179954","2020-10-21","18:00:00",""
"7024979","10.7792","0.0003","15.7625","0.0008","15.3052","0.0007","90","","97.193","0.003","90","","2580","0.19","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H39 N2 P -","- C31 H39 N2 P -","- C124 H156 N8 P4 -","4","1","","Seacome, Richard J.; Coles, Martyn P.; Glover, Jean E.; Hitchcock, Peter B.; Rowlands, Gareth J.","Planar-chiral imidazole-based phosphine ligands derived from [2.2]paracyclophane","Dalton Transactions","2010","39","15","3687","","10.1039/b923716j","","x-ray","0.71073","MoKα","","0.1847","0.0947","","","0.141","0.1684","","","","","","1.111","","","","has coordinates","179954","2020-10-21","18:00:00",""
"7024980","9.1186","0.0003","11.6152","0.0003","13.9871","0.0004","105.127","0.001","105.574","0.002","102.542","0.002","1310.24","0.07","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C30 H41 N2 O P -","- C30 H41 N2 O P -","- C60 H82 N4 O2 P2 -","2","1","","Seacome, Richard J.; Coles, Martyn P.; Glover, Jean E.; Hitchcock, Peter B.; Rowlands, Gareth J.","Planar-chiral imidazole-based phosphine ligands derived from [2.2]paracyclophane","Dalton Transactions","2010","39","15","3687","","10.1039/b923716j","","x-ray","0.71073","MoKα","","0.0686","0.0543","","","0.1426","0.1532","","","","","","1.045","","","","has coordinates","179954","2020-10-21","18:00:00",""
"7024981","7.7953","0.0002","13.8315","0.0003","13.0449","0.0003","90","","91.366","0.002","90","","1406.11","0.06","173","2","173","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C28 H37 Cl4 N2 P Pd -","- C28 H37 Cl4 N2 P Pd -","- C56 H74 Cl8 N4 P2 Pd2 -","2","1","","Seacome, Richard J.; Coles, Martyn P.; Glover, Jean E.; Hitchcock, Peter B.; Rowlands, Gareth J.","Planar-chiral imidazole-based phosphine ligands derived from [2.2]paracyclophane","Dalton Transactions","2010","39","15","3687","","10.1039/b923716j","","x-ray","0.71073","MoKα","","0.0401","0.0383","","","0.1049","0.1067","","","","","","1.045","","","","has coordinates","179954","2020-10-21","18:00:00",""
"7025020","17.546","0.0011","37.803","0.0011","9.994","0.002","90","0.005","90","0.004","90","0.005","6628.9","1.4","150","2","150","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C22 H40 Cl2 Cu2 N4 O15 -","- C22 H40 Cl2 Cu2 N4 O15 -","- C176 H320 Cl16 Cu16 N32 O120 -","8","0.5","","Maxim, Catalin; Sorace, Lorenzo; Khuntia, Panchanana; Madalan, Augustin M.; Kravtsov, Victor; Lascialfari, Alessandro; Caneschi, Andrea; Journaux, Yves; Andruh, Marius","A missing high-spin molecule in the family of cyanido-bridged heptanuclear heterometal complexes, [(LCuII)6FeIII(CN)6]3+, and its CoIII and CrIII analogues, accompanied in the crystal by a novel octameric water cluster","Dalton Transactions","2010","39","20","4838","","10.1039/b924505g","","","0.71073","MoKα","","0.0643","0.044","","","0.1002","0.1055","","","","","","1.002","","","","has coordinates,has disorder","179955","2020-10-21","18:00:00",""
"7025021","27.8777","0.0016","27.8777","0.0016","21.369","0.0013","90","","90","","120","","14382.3","1.5","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C72 H118 Cl3 Cu6 Fe N18 O32 -","- C72 H90 Cl3 Cu6 Fe N18 O32 -","- C432 H540 Cl18 Cu36 Fe6 N108 O192 -","6","0.166667","","Maxim, Catalin; Sorace, Lorenzo; Khuntia, Panchanana; Madalan, Augustin M.; Kravtsov, Victor; Lascialfari, Alessandro; Caneschi, Andrea; Journaux, Yves; Andruh, Marius","A missing high-spin molecule in the family of cyanido-bridged heptanuclear heterometal complexes, [(LCuII)6FeIII(CN)6]3+, and its CoIII and CrIII analogues, accompanied in the crystal by a novel octameric water cluster","Dalton Transactions","2010","39","20","4838","","10.1039/b924505g","","","0.71073","MoKα","","0.0959","0.0573","","","0.1488","0.1701","","","","","","1.003","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025022","27.9545","0.0019","27.9545","0.0019","21.3938","0.0016","90","","90","","120","","14478.4","1.8","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C72 H118 Cl3 Co Cu6 N18 O32 -","- C72 H90 Cl3 Co Cu6 N18 O32 -","- C432 H540 Cl18 Co6 Cu36 N108 O192 -","6","0.166667","","Maxim, Catalin; Sorace, Lorenzo; Khuntia, Panchanana; Madalan, Augustin M.; Kravtsov, Victor; Lascialfari, Alessandro; Caneschi, Andrea; Journaux, Yves; Andruh, Marius","A missing high-spin molecule in the family of cyanido-bridged heptanuclear heterometal complexes, [(LCuII)6FeIII(CN)6]3+, and its CoIII and CrIII analogues, accompanied in the crystal by a novel octameric water cluster","Dalton Transactions","2010","39","20","4838","","10.1039/b924505g","","","0.71073","MoKα","","0.1266","0.0623","","","0.0993","0.1166","","","","","","1.056","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025023","28.1","0.002","28.1","0.002","21.656","0.002","90","","90","","120","","14809","2","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C72 H118 Cl3 Cr Cu6 N18 O32 -","- C72 H90 Cl3 Cr Cu6 N18 O32 -","- C432 H540 Cl18 Cr6 Cu36 N108 O192 -","6","0.166667","","Maxim, Catalin; Sorace, Lorenzo; Khuntia, Panchanana; Madalan, Augustin M.; Kravtsov, Victor; Lascialfari, Alessandro; Caneschi, Andrea; Journaux, Yves; Andruh, Marius","A missing high-spin molecule in the family of cyanido-bridged heptanuclear heterometal complexes, [(LCuII)6FeIII(CN)6]3+, and its CoIII and CrIII analogues, accompanied in the crystal by a novel octameric water cluster","Dalton Transactions","2010","39","20","4838","","10.1039/b924505g","","","0.71073","MoKα","","0.1529","0.0568","","","0.088","0.1097","","","","","","0.981","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025053","14.139","0.006","15.162","0.005","20.726","0.005","78.212","0.018","86.77","0.02","70.32","0.03","4095","3","208","2","208","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H72 Mn8 N16 O15 -","- C84 H72 Mn8 N16 O15 -","- C168 H144 Mn16 N32 O30 -","2","1","","Viciano-Chumillas, Marta; de Ruiter, Graham; Tanase, Stefania; Smits, Jan M. M.; de Gelder, René; Mutikainen, Ilpo; Turpeinen, Urho; de Jongh, L. Jos; Reedijk, Jan","High nuclearity manganese(iii) compounds containing phenol-pyrazole ligands: the influence of the ligand on the core geometry","Dalton Transactions","2010","39","20","4991","","10.1039/b924776a","","","0.71073","MoKα","","0.2287","0.1161","","","0.1882","0.233","","","","","","1.066","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025054","14.589","0.002","28.014","0.004","24.429","0.004","90","","103.478","0.016","90","","9709","3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C78.5 H85 Br2 Cl3 Mn6 N14 O14.5 -","- C78.5 H79 Br2 Cl3 Mn6 N14 O14.49 -","- C314 H316 Br8 Cl12 Mn24 N56 O57.96 -","4","1","","Viciano-Chumillas, Marta; de Ruiter, Graham; Tanase, Stefania; Smits, Jan M. M.; de Gelder, René; Mutikainen, Ilpo; Turpeinen, Urho; de Jongh, L. Jos; Reedijk, Jan","High nuclearity manganese(iii) compounds containing phenol-pyrazole ligands: the influence of the ligand on the core geometry","Dalton Transactions","2010","39","20","4991","","10.1039/b924776a","","","0.71073","MoKα","","0.0948","0.058","","","0.1416","0.1595","","","","","","1.09","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7025055","15.284","0.003","15.918","0.003","18.924","0.003","82.82","0.03","69.5","0.03","84.94","0.03","4273.8","1.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H84 Mn8 N16 O18 -","- C84 H84 Mn8 N16 O18 -","- C168 H168 Mn16 N32 O36 -","2","1","","Viciano-Chumillas, Marta; de Ruiter, Graham; Tanase, Stefania; Smits, Jan M. M.; de Gelder, René; Mutikainen, Ilpo; Turpeinen, Urho; de Jongh, L. Jos; Reedijk, Jan","High nuclearity manganese(iii) compounds containing phenol-pyrazole ligands: the influence of the ligand on the core geometry","Dalton Transactions","2010","39","20","4991","","10.1039/b924776a","","","0.71073","MoKα","","0.0935","0.0463","","","0.0848","0.1011","","","","","","1.064","","","","has coordinates,has disorder","179955","2020-10-21","18:00:00",""
"7025066","12.26","0.005","12.366","0.006","19.101","0.009","78.18","0.016","84.625","0.016","89.511","0.017","2822","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H64 Co6 Na4 O52 -","- C24 H16 Co6 Na4 O52 -","- C48 H32 Co12 Na8 O104 -","2","1","","Galloway, Kyle W.; Schmidtmann, Marc; Sanchez-Benitez, Javier; Kamenev, Konstantin V.; Wernsdorfer, Wolfgang; Murrie, Mark","Slow magnetic relaxation in a 3D network of cobalt(ii) citrate cubanes","Dalton Transactions","2010","39","20","4727","","10.1039/b924803j","","","0.71073","MoKα","","0.18","0.1185","","","0.2866","0.3311","","","","","","1.181","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025069","11.9452","0.0007","13.0013","0.0008","14.0001","0.0008","111.129","0.004","90.096","0.005","96.75","0.004","2011.8","0.2","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C33 H46 Mn3 N10 O13 -","- C33 H46 Mn3 N10 O13 -","- C66 H92 Mn6 N20 O26 -","2","1","","Escuer, Albert; Cordero, Beatriz; Font-Bardia, Mercé; Calvet, Teresa; Roubeau, Olivier; Teat, Simon J.; Fedi, Serena; Fabrizi de Biani, Fabrizia","Manganese clusters derived from a 2,6-diacetylpyridine dioximato ligand: structure and magnetic study","Dalton Transactions","2010","39","20","4817","","10.1039/b924977j","","x-ray","0.7107","MoKα","","0.0752","0.0504","","","0.1475","0.1605","","","","","","1.109","","","","has coordinates,has disorder","179955","2020-10-21","18:00:00",""
"7025070","18.169","0.011","14.096","0.007","13.809","0.006","90","","95.27","0.03","90","","3522","3","203","2","203","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C54 H56 Mn8 N20 O21 -","- C54 H54 Mn8 N20 O21 -","- C108 H108 Mn16 N40 O42 -","2","0.25","","Escuer, Albert; Cordero, Beatriz; Font-Bardia, Mercé; Calvet, Teresa; Roubeau, Olivier; Teat, Simon J.; Fedi, Serena; Fabrizi de Biani, Fabrizia","Manganese clusters derived from a 2,6-diacetylpyridine dioximato ligand: structure and magnetic study","Dalton Transactions","2010","39","20","4817","","10.1039/b924977j","","","0.71073","MoKα","","0.1301","0.0758","","","0.1996","0.2284","","","","","","1.052","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025071","17.4072","0.0012","11.777","0.0008","6.4972","0.0005","90","","105.733","0.002","90","","1282.06","0.16","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H11 Mn N9 O2 -","- C9 H11 Mn N9 O2 -","- C36 H44 Mn4 N36 O8 -","4","0.5","","Escuer, Albert; Cordero, Beatriz; Font-Bardia, Mercé; Calvet, Teresa; Roubeau, Olivier; Teat, Simon J.; Fedi, Serena; Fabrizi de Biani, Fabrizia","Manganese clusters derived from a 2,6-diacetylpyridine dioximato ligand: structure and magnetic study","Dalton Transactions","2010","39","20","4817","","10.1039/b924977j","","","0.7749","synchrotron","","0.0321","0.03","","","0.0764","0.0773","","","","","","1.057","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025080","9.76","0.002","10.7312","0.0019","31.542","0.007","90","0.016","95.132","0.018","90","0.016","3290.4","1.2","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C37 H41 N9 -","- C37 H41 N9 -","- C148 H164 N36 -","4","1","","Lewis, Frank W.; Harwood, Laurence M.; Hudson, Michael J.; Drew, Michael G. B.; Modolo, Giuseppe; Sypula, Michal; Desreux, Jean F.; Bouslimani, Nouri; Vidick, Geoffrey","Interaction of 6,6′′-bis(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-yl)-2,2′:6′,2′′-terpyridine (CyMe4-BTTP) with some trivalent ions such as lanthanide(iii) ions and americium(iii)","Dalton Transactions","2010","39","21","5172","","10.1039/b924988e","","","0.71073","MoKα","","0.1556","0.0741","","","0.161","0.188","","","","","","0.92","","","","has coordinates","179955","2020-10-21","18:00:00",""
"7025081","13.0611","0.0005","13.7135","0.0007","15.7947","0.0006","108.832","0.004","105.958","0.003","98.035","0.004","2491.9","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H53 Cl3 N9 O18 Y -","- C37 H41 Cl3 N9 O18 Y -","- C74 H82 Cl6 N18 O36 Y2 -","2","1","","Lewis, Frank W.; Harwood, Laurence M.; Hudson, Michael J.; Drew, Michael G. B.; Modolo, Giuseppe; Sypula, Michal; Desreux, Jean F.; Bouslimani, Nouri; Vidick, Geoffrey","Interaction of 6,6′′-bis(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-yl)-2,2′:6′,2′′-terpyridine (CyMe4-BTTP) with some trivalent ions such as lanthanide(iii) ions and americium(iii)","Dalton Transactions","2010","39","21","5172","","10.1039/b924988e","","","0.71073","MoKα","","0.1631","0.1054","","","0.2522","0.2828","","","","","","1.03","","","","has coordinates,has disorder","179955","2020-10-21","18:00:00",""
"7025125","11.4643","0.0004","12.0792","0.0005","19.953","0.0007","77.597","0.002","88.046","0.002","72.215","0.002","2568.15","0.17","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H67 Co Fe2 N3 O14 -","- C42 H67 Co Fe2 N3 O14 -","- C84 H134 Co2 Fe4 N6 O28 -","2","1","","Alborés, Pablo; Rentschler, Eva","Rational design of covalently bridged [FeIII2MIIO] clusters","Dalton Transactions","2010","39","20","5005","","10.1039/b925214b","","","0.71073","MoKα","","0.0854","0.0455","","","0.1016","0.1209","","","","","","1.044","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025126","11.446","0.0007","12.037","0.0007","19.959","0.0012","77.711","0.002","88.033","0.002","72.212","0.002","2557","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H67 Fe2 N3 Ni O14 -","- C42 H67 Fe2 N3 Ni O14 -","- C84 H134 Fe4 N6 Ni2 O28 -","2","1","","Alborés, Pablo; Rentschler, Eva","Rational design of covalently bridged [FeIII2MIIO] clusters","Dalton Transactions","2010","39","20","5005","","10.1039/b925214b","","","0.71069","MoKα","","0.0534","0.0354","","","0.0889","0.1007","","","","","","1.045","","","","has coordinates,has disorder","179956","2020-10-21","18:00:00",""
"7025127","11.5312","0.0007","12.2514","0.0008","19.4796","0.0013","78.256","0.002","86.361","0.002","74.106","0.002","2591.2","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H67 Fe2 Mn N3 O14 -","- C44 H67 Fe2 Mn N3 O14 -","- C88 H134 Fe4 Mn2 N6 O28 -","2","1","","Alborés, Pablo; Rentschler, Eva","Rational design of covalently bridged [FeIII2MIIO] clusters","Dalton Transactions","2010","39","20","5005","","10.1039/b925214b","","","0.71069","MoKα","","0.1085","0.0518","","","0.0976","0.1217","","","","","","0.991","","","","has coordinates,has disorder","179956","2020-10-21","18:00:00",""
"7025128","11.8218","0.001","13.6367","0.0012","18.0729","0.0016","109.112","0.002","105.071","0.003","107.185","0.003","2415.9","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H124 Co2 Fe4 N6 O28 -","- C72 H124 Co2 Fe4 N6 O28 -","- C72 H124 Co2 Fe4 N6 O28 -","1","0.5","","Alborés, Pablo; Rentschler, Eva","Rational design of covalently bridged [FeIII2MIIO] clusters","Dalton Transactions","2010","39","20","5005","","10.1039/b925214b","","","0.71069","MoKα","","0.1514","0.0629","","","0.1206","0.1555","","","","","","0.943","","","","has coordinates,has disorder","179956","2020-10-21","18:00:00",""
"7025129","11.7753","0.0004","13.5794","0.0004","17.9814","0.0006","108.749","0.0012","105.762","0.0012","106.822","0.0012","2385.95","0.14","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H124 Fe4 N6 Ni2 O28 -","- C72 H124 Fe4 N6 Ni2 O28 -","- C72 H124 Fe4 N6 Ni2 O28 -","1","0.5","","Alborés, Pablo; Rentschler, Eva","Rational design of covalently bridged [FeIII2MIIO] clusters","Dalton Transactions","2010","39","20","5005","","10.1039/b925214b","","","0.71069","MoKα","","0.0531","0.0371","","","0.0933","0.1036","","","","","","1.048","","","","has coordinates,has disorder","179956","2020-10-21","18:00:00",""
"7025130","14.617","0.0016","16.8069","0.0018","20.971","0.002","90","","93.166","0.004","90","","5144","0.9","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C76 H130 Fe4 Mn2 N8 O28 -","- C76 H130 Fe4 Mn2 N8 O28 -","- C152 H260 Fe8 Mn4 N16 O56 -","2","0.5","","Alborés, Pablo; Rentschler, Eva","Rational design of covalently bridged [FeIII2MIIO] clusters","Dalton Transactions","2010","39","20","5005","","10.1039/b925214b","","","0.71069","MoKα","","0.2469","0.0584","","","0.1104","0.174","","","","","","0.958","","","","has coordinates,has disorder","179956","2020-10-21","18:00:00",""
"7025134","13.672","0.0004","19.608","0.0006","27.957","0.0009","90","","103.635","0.001","90","","7283.5","0.4","150","","150","","","","","","","","C. Milios, CM1691","5","P 1 21/c 1","-P 2ybc","14","","","","- C71 H74.5 Mn4 N11.5 O16 -","- C64 H60 Mn4 N8 O16 -","- C256 H240 Mn16 N32 O64 -","4","1","","Inglis, Ross; Stoumpos, Constantinos C.; Prescimone, Alessandro; Siczek, Milosz; Lis, Tadeusz; Wernsdorfer, Wolfgang; Brechin, Euan K.; Milios, Constantinos J.","Ferromagnetic manganese “cubes”: from PSII to single-molecule magnets","Dalton Transactions","2010","39","20","4777","","10.1039/b925248g","","","0.71073","MoKα","","0.083","0.0465","","0.054","0.0475","0.0475","","","","","","1.1297","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025135","21.8339","0.0005","20.0435","0.0004","39.9737","0.0009","90","","92.985","0.001","90","","17469.9","0.7","150","","150","","","","","","","","Ross Inglis, RI885","5","C 1 2/c 1","-C 2yc","15","","","","- C100 H90 Mn4 N8 O19 -","- C92 H70 Mn4 N8 O17 -","- C736 H560 Mn32 N64 O136 -","8","1","","Inglis, Ross; Stoumpos, Constantinos C.; Prescimone, Alessandro; Siczek, Milosz; Lis, Tadeusz; Wernsdorfer, Wolfgang; Brechin, Euan K.; Milios, Constantinos J.","Ferromagnetic manganese “cubes”: from PSII to single-molecule magnets","Dalton Transactions","2010","39","20","4777","","10.1039/b925248g","","","0.71073","MoKα","","0.1338","0.0794","","0.2186","0.163","0.2186","","","","","","1.0005","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025136","13.14","0.004","49.51","0.03","22.596","0.007","90","","98.37","0.03","90","","14544","11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C73.5 H78.25 Mn4 N8.75 O16 -","- C73.5 H78.25 Mn4 N8.75 O16 -","- C588 H626 Mn32 N70 O128 -","8","2","","Inglis, Ross; Stoumpos, Constantinos C.; Prescimone, Alessandro; Siczek, Milosz; Lis, Tadeusz; Wernsdorfer, Wolfgang; Brechin, Euan K.; Milios, Constantinos J.","Ferromagnetic manganese “cubes”: from PSII to single-molecule magnets","Dalton Transactions","2010","39","20","4777","","10.1039/b925248g","","","0.71073","MoKα","","0.1668","0.0709","","","0.0861","0.0976","","","","","","1.004","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7025147","10.3057","0.0017","14.806","0.002","15.877","0.003","107.701","0.002","107.261","0.002","99.251","0.002","2118.4","0.6","200","2","200","2","","","","","","","","6","P 1","P 1","1","","","","- C87 H96 Cl6 N12 Ni3 O3 -","- C87 H96 Cl6 N12 Ni3 O3 -","- C87 H96 Cl6 N12 Ni3 O3 -","1","1","","Shiga, Takuya; Newton, Graham N.; Mathieson, Jennifer S.; Tetsuka, Tamaki; Nihei, Masayuki; Cronin, Leroy; Oshio, Hiroki","Ferromagnetically coupled chiral cyanide-bridged {Ni6Fe4} cages","Dalton Transactions","2010","39","20","4730","","10.1039/b925399h","","","0.71073","MoKα","","0.0276","0.0269","","","0.0704","0.0709","","","","","","1.016","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025148","10.322","0.0017","14.819","0.003","15.883","0.003","107.65","0.003","107.289","0.002","99.278","0.003","2124.5","0.7","200","2","200","2","","","","","","","","6","P 1","P 1","1","","","","- C87 H96 Cl6 N12 Ni3 O3 -","- C87 H96 Cl6 N12 Ni3 O3 -","- C87 H96 Cl6 N12 Ni3 O3 -","1","1","","Shiga, Takuya; Newton, Graham N.; Mathieson, Jennifer S.; Tetsuka, Tamaki; Nihei, Masayuki; Cronin, Leroy; Oshio, Hiroki","Ferromagnetically coupled chiral cyanide-bridged {Ni6Fe4} cages","Dalton Transactions","2010","39","20","4730","","10.1039/b925399h","","","0.71073","MoKα","","0.0417","0.0385","","","0.0908","0.0923","","","","","","1.001","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025149","19.567","0.005","19.567","0.005","35.123","0.013","90","","90","","120","","11646","6","200","2","200","2","","","","","","","","8","P 3","P 3","143","","","","- C231 H332 F6 Fe4 N49 Ni6 O41 P -","- C199.985 H168 F6 Fe4 N49 Ni6 P -","- C399.97 H336 F12 Fe8 N98 Ni12 P2 -","2","0.666667","","Shiga, Takuya; Newton, Graham N.; Mathieson, Jennifer S.; Tetsuka, Tamaki; Nihei, Masayuki; Cronin, Leroy; Oshio, Hiroki","Ferromagnetically coupled chiral cyanide-bridged {Ni6Fe4} cages","Dalton Transactions","2010","39","20","4730","","10.1039/b925399h","","","0.71073","MoKα","","0.1489","0.0809","","","0.1749","0.1976","","","","","","0.869","","","","has coordinates,has disorder","179956","2020-10-21","18:00:00",""
"7025150","19.574","0.003","19.574","0.003","35.075","0.009","90","","90","","120","","11638","4","200","2","200","2","","","","","","","","8","P 3","P 3","143","","","","- C233 H340 F6 Fe4 N49 Ni6 O43 P -","- C199.98 H168 F6 Fe4 N49 Ni6 P -","- C399.96 H336 F12 Fe8 N98 Ni12 P2 -","2","0.666667","","Shiga, Takuya; Newton, Graham N.; Mathieson, Jennifer S.; Tetsuka, Tamaki; Nihei, Masayuki; Cronin, Leroy; Oshio, Hiroki","Ferromagnetically coupled chiral cyanide-bridged {Ni6Fe4} cages","Dalton Transactions","2010","39","20","4730","","10.1039/b925399h","","","0.71073","MoKα","","0.1577","0.0684","","","0.1346","0.1556","","","","","","0.775","","","","has coordinates,has disorder","179956","2020-10-21","18:00:00",""
"7025151","19.3054","0.0006","15.4938","0.0003","21.6876","0.0007","90","","98.176","0.002","90","","6421.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H46 Dy2 N8 Ni2 O32 -","- C52 H46 Dy2 N8 Ni2 O32 -","- C208 H184 Dy8 N32 Ni8 O128 -","4","1","","Pasatoiu, Traian D.; Etienne, Mael; Madalan, Augustin M.; Andruh, Marius; Sessoli, Roberta","Dimers and chains of {3d‒4f} single molecule magnets constructed from heterobimetallic tectons","Dalton Transactions","2010","39","20","4802","","10.1039/b925425k","","","0.71073","MoKα","","0.0846","0.0507","","","0.0977","0.1068","","","","","","1.029","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025152","11.6443","0.0004","16.3722","0.0004","19.2871","0.0008","90","","97.641","0.003","90","","3644.3","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C70 H64 Dy2 N8 Ni2 O22 -","- C70 H64 Dy2 N8 Ni2 O22 -","- C140 H128 Dy4 N16 Ni4 O44 -","2","0.5","","Pasatoiu, Traian D.; Etienne, Mael; Madalan, Augustin M.; Andruh, Marius; Sessoli, Roberta","Dimers and chains of {3d‒4f} single molecule magnets constructed from heterobimetallic tectons","Dalton Transactions","2010","39","20","4802","","10.1039/b925425k","","","0.71073","MoKα","","0.0902","0.0585","","","0.0919","0.0996","","","","","","1.114","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025158","9.778","0.002","23.745","0.005","10.281","0.002","90","","103.96","0.03","90","","2316.5","0.9","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N6 O2 -","- C26 H20 Fe N6 O2 -","- C104 H80 Fe4 N24 O8 -","4","1","","Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song","Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere","Dalton Transactions","2010","39","20","4856","","10.1039/b925482j","","","0.71073","MoKα","","0.0551","0.0304","","","0.0714","0.0761","","","","","","1","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025159","9.982","0.002","20.133","0.004","12.113","0.002","90","","91.63","0.03","90","","2433.3","0.8","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C28 H24 Fe N6 O2 -","- C28 H24 Fe N6 O2 -","- C112 H96 Fe4 N24 O8 -","4","1","","Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song","Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere","Dalton Transactions","2010","39","20","4856","","10.1039/b925482j","","","0.71073","MoKα","","0.1389","0.1066","","","0.2487","0.2654","","","","","","1","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025160","11.036","0.002","12.326","0.003","12.517","0.003","66.63","0.03","83.03","0.03","81.18","0.03","1541.1","0.7","290","2","290","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H28 Cl0 Fe N6 O2 -","- C38 H28 Fe N6 O2 -","- C76 H56 Fe2 N12 O4 -","2","1","","Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song","Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere","Dalton Transactions","2010","39","20","4856","","10.1039/b925482j","","","0.71073","MoKα","","0.0774","0.0374","","","0.06","0.0651","","","","","","1","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025161","18.485","0.004","24.52","0.005","11.575","0.002","90","","104.7","0.03","90","","5074.7","1.9","290","2","290","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H42 Cl0 Fe2 N12 O9 -","- C52 H42 Fe2 N12 O9 -","- C208 H168 Fe8 N48 O36 -","4","0.5","","Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song","Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere","Dalton Transactions","2010","39","20","4856","","10.1039/b925482j","","","0.71073","MoKα","","0.1103","0.0497","","","0.1322","0.1547","","","","","","0.997","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025162","12.398","0.003","18.807","0.004","10.325","0.002","90","","90","","90","","2407.5","0.9","110","2","110","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C28 H24 Fe N6 O4 -","- C28 H24 Fe N6 O4 -","- C112 H96 Fe4 N24 O16 -","4","","","Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song","Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere","Dalton Transactions","2010","39","20","4856","","10.1039/b925482j","","","0.71073","MoKα","","0.0437","0.0297","","","0.0631","0.0665","","","","","","1.011","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7025163","12.58","0.003","18.805","0.004","10.589","0.002","90","","90","","90","","2505","0.9","290","2","290","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C28 H24 Fe N6 O4 -","- C28 H24 Fe N6 O4 -","- C112 H96 Fe4 N24 O16 -","4","","","Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song","Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere","Dalton Transactions","2010","39","20","4856","","10.1039/b925482j","","","0.71073","MoKα","","0.1407","0.0445","","","0.0496","0.0598","","","","","","0.965","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7025164","10.652","0.002","13.796","0.003","22.181","0.004","90","","91.87","0.03","90","","3257.9","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H28 Fe N6 O4 -","- C38 H28 Fe N6 O4 -","- C152 H112 Fe4 N24 O16 -","4","1","","Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song","Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere","Dalton Transactions","2010","39","20","4856","","10.1039/b925482j","","","0.71073","MoKα","","0.119","0.0435","","","0.0585","0.0649","","","","","","1.037","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025189","11.376","0.002","19.307","0.004","12.927","0.003","90","","111.6","0.03","90","","2639.9","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H23 B N2 O2 -","- C35 H23 B N2 O2 -","- C140 H92 B4 N8 O8 -","4","1","","Zhang, Zuolun; Yao, Dandan; Zhao, Shanshan; Gao, Hongze; Fan, Yan; Su, Zhongmin; Zhang, Hongyu; Wang, Yue","Carbazolyl-contained phenol-pyridyl boron complexes: syntheses, structures, photoluminescent and electroluminescent properties","Dalton Transactions","2010","39","21","5123","","10.1039/b925608c","","","0.71073","MoKα","","0.0961","0.0531","","","0.1266","0.1473","","","","","","0.978","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025190","10.324","0.002","29.638","0.006","11.364","0.002","90","","106.61","0.03","90","","3332.1","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H28 B Cl3 N2 O2 -","- C38 H28 B Cl3 N2 O2 -","- C152 H112 B4 Cl12 N8 O8 -","4","1","","Zhang, Zuolun; Yao, Dandan; Zhao, Shanshan; Gao, Hongze; Fan, Yan; Su, Zhongmin; Zhang, Hongyu; Wang, Yue","Carbazolyl-contained phenol-pyridyl boron complexes: syntheses, structures, photoluminescent and electroluminescent properties","Dalton Transactions","2010","39","21","5123","","10.1039/b925608c","","","0.71073","MoKα","","0.1322","0.0833","","","0.2607","0.3101","","","","","","0.939","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025191","32.791","0.007","11.692","0.002","11.615","0.002","90","","90.69","0.03","90","","4452.8","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H44 B Cl3 N2 O2 -","- C50 H44 B Cl3 N2 O2 -","- C200 H176 B4 Cl12 N8 O8 -","4","1","","Zhang, Zuolun; Yao, Dandan; Zhao, Shanshan; Gao, Hongze; Fan, Yan; Su, Zhongmin; Zhang, Hongyu; Wang, Yue","Carbazolyl-contained phenol-pyridyl boron complexes: syntheses, structures, photoluminescent and electroluminescent properties","Dalton Transactions","2010","39","21","5123","","10.1039/b925608c","","","0.71073","MoKα","","0.209","0.1057","","","0.2585","0.316","","","","","","1.096","","","","has coordinates","179956","2020-10-21","18:00:00",""
"7025236","10.545","0.0017","10.8584","0.0018","11.0244","0.0019","83.531","0.002","70.24","0.001","66.554","0.001","1089.6","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H15 Cu2 N5 O13 W3 -","- C14 H15 Cu2 N5 O13 W3 -","- C28 H30 Cu4 N10 O26 W6 -","2","1","","Cui, Feng-Yun; Huang, Kun-Lin; Ma, Xiao-Yu; Li, Cong; Han, Zhan-Gang; Gao, Yuan-Zhe; Liu, Xi; Chi, Ying-Nan; Hu, Chang-Wen","Transformation from [W6O19]2− to [W6O22]8− stabilized by Cu(ii) complexation","Dalton Transactions","2010","39","21","5080","","10.1039/b926024b","","","0.71073","MoKα","","0.0567","0.0388","","","0.0907","0.1006","","","","","","1.002","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025237","12.0461","0.0013","12.8977","0.0014","13.7956","0.0013","98.072","0.001","109.987","0.001","117.834","0.002","1661.1","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H38 Cl2 Cu2 N18 O19 W6 -","- C56 H38 Cl2 Cu2 N18 O19 W6 -","- C56 H38 Cl2 Cu2 N18 O19 W6 -","1","0.5","","Cui, Feng-Yun; Huang, Kun-Lin; Ma, Xiao-Yu; Li, Cong; Han, Zhan-Gang; Gao, Yuan-Zhe; Liu, Xi; Chi, Ying-Nan; Hu, Chang-Wen","Transformation from [W6O19]2− to [W6O22]8− stabilized by Cu(ii) complexation","Dalton Transactions","2010","39","21","5080","","10.1039/b926024b","","","0.71073","MoKα","","0.0457","0.0331","","","0.0911","0.0981","","","","","","1.012","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025264","12.01279","0.00011","14.83093","0.00015","14.57556","0.00013","90","","90.2171","0.00043","90","","2596.78","0.04","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(Cd(en)3)(Cd(SC6H4S)2)","","","- C18 H32 Cd2 N6 S4 -","- C18 H32 Cd2 N6 S4 -","- C72 H128 Cd8 N24 S16 -","4","0.5","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.696745","","","","","","","","","","","1.781","","","","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025265","11.87713","0.00027","14.71177","0.00043","14.62618","0.00029","90","","90.4127","0.00095","90","","2555.62","0.11","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(Mg(en)3)(Cd(SC6H4S)2)","","","- C18 H32 Cd1.187 Mg0.813 N6 S4 -","- C18 H32 Cd1.188 Mg0.812 N6 S4 -","- C72 H128 Cd4.752 Mg3.248 N24 S16 -","4","0.5","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.698525","","","","","","","","","","","1.323","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7025266","12.01276","0.00026","14.67424","0.00034","15.20217","0.00031","90","","89.1191","0.00094","90","","2679.49","0.1","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(Cd(en)3)(Cd(SeC6H4Se)2)","","","- C18 H32 Cd2 N6 Se4 -","- C18 H32 Cd2 N6 Se4 -","- C72 H128 Cd8 N24 Se16 -","4","0.5","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.696942","","","","","","","","","","","1.448","","","","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025267","11.65582","0.00032","15.24511","0.00054","14.21869","0.0004","90","","90.6517","0.0013","90","","2526.42","0.13","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(Zn(en)3)(Zn(SC6H4S)2)","","","- C18 H32 N6 S4 Zn2 -","- C18 H32 N6 S4 Zn2 -","- C72 H128 N24 S16 Zn8 -","4","0.5","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.696951","","","","","","","","","","","2.177","","","","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025268","11.49545","0.00056","10.67562","0.00051","8.7019","0.00036","58.523","0.002","106.498","0.0032","110.981","0.0028","844.05","0.07","298","","298","","","","","","","","","5","P -1","-P 1","2","(NMe4)2(Cd2(SC6H4S)3)","","","- C13 H18 Cd N S3 -","- C13 H18 Cd N S3 -","- C26 H36 Cd2 N2 S6 -","2","1","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.697907","","","","","","","","","","","2.506","","","","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025269","9.04393","0.00076","9.60952","0.00071","12.1736","0.0011","94.7168","0.0068","80.1422","0.0079","68.6195","0.0069","958.49","0.15","298","","298","","","","","","","","","5","P -1","-P 1","2","(NEt4)2(Cd2(SC6H4S)3)","","","- C17 H26 Cd N S3 -","- C17 H26 Cd N S3 -","- C34 H52 Cd2 N2 S6 -","2","1","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.598191","","","","","","","","","","","1.522","","","","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025270","11.7613","0.00051","10.84","0.00047","8.85827","0.00035","58.4655","0.0023","106.709","0.0035","111.835","0.0033","887.33","0.07","298","","298","","","","","","","","","5","P -1","-P 1","2","(NMe4)2(Cd2(SeC6H4Se)3)","","","- C13 H18 Cd N Se3 -","- C13 H18 Cd N Se3 -","- C26 H36 Cd2 N2 Se6 -","2","1","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.698092","","","","","","","","","","","1.787","","","","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025271","43.68499","0.00025","8.815705","0.000044","18.89291","0.00011","90","","73.8657","0.00036","90","","6989.35","0.07","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H98 N18 S10 Zn5 -","- C54 H98 N18 S10 Zn5 -","- C216 H392 N72 S40 Zn20 -","4","0.5","","Turner, Dayna L.; Stone, Kevin H.; Stephens, Peter W.; Vaid, Thomas P.","Cadmium and zinc thiolate and selenolate metal‒organic frameworks","Dalton Transactions","2010","39","21","5070","","10.1039/b926156g","powder diffraction","","0.698431","","","","","","","","","","","1.754","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7025291","13.913","0.002","13.913","0.002","23.141","0.005","90","","90","","120","","3879.3","1.2","150","2","150","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","[Ni7(OH)6(L1)6](NO3)2.2MeOH","","","- C56 H66 N8 Ni7 O26 -","- C55.98 H66 N8 Ni7 O26.01 -","- C111.96 H132 N16 Ni14 O52.02 -","2","0.166667","","Meally, Seán T.; McDonald, Cecelia; Karotsis, Georgios; Papaefstathiou, Giannis S.; Brechin, Euan K.; Dunne, Peter W.; McArdle, Patrick; Power, Nicholas P.; Jones, Leigh F.","A family of double-bowl pseudo metallocalix[6]arene discs","Dalton Transactions","2010","39","20","4809","","10.1039/b926704b","","","0.7107","MoKα","","0.0751","0.0679","","","0.2101","0.2155","","","","","","1.047","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025292","13.902","0.002","13.902","0.002","23.353","0.005","90","","90","","120","","3908.7","1.2","150","2","150","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","[Zn7(OH)6(L1)6](NO3)2.2MeOH.H2O","","","- C56 H66 N8 O27 Zn7 -","- C56.01 H66 N8 O27.03 Zn7 -","- C112.02 H132 N16 O54.06 Zn14 -","2","0.166667","","Meally, Seán T.; McDonald, Cecelia; Karotsis, Georgios; Papaefstathiou, Giannis S.; Brechin, Euan K.; Dunne, Peter W.; McArdle, Patrick; Power, Nicholas P.; Jones, Leigh F.","A family of double-bowl pseudo metallocalix[6]arene discs","Dalton Transactions","2010","39","20","4809","","10.1039/b926704b","","","0.7107","MoKα","","0.0838","0.0628","","","0.199","0.2107","","","","","","1.139","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025293","14.082","0.002","14.082","0.002","22.759","0.005","90","","90","","120","","3908.5","1.2","150","2","150","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","[Zn7(OH)6(immp)6](NO3)2.3MeNO2","","","- C57 H66 N11 O30 Zn7 -","- C57 H66 N11 O30 Zn7 -","- C114 H132 N22 O60 Zn14 -","2","0.166667","","Meally, Seán T.; McDonald, Cecelia; Karotsis, Georgios; Papaefstathiou, Giannis S.; Brechin, Euan K.; Dunne, Peter W.; McArdle, Patrick; Power, Nicholas P.; Jones, Leigh F.","A family of double-bowl pseudo metallocalix[6]arene discs","Dalton Transactions","2010","39","20","4809","","10.1039/b926704b","","","0.7107","MoKα","","0.0769","0.0713","","","0.2035","0.2079","","","","","","1.119","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025294","20.3117","0.0003","17.8243","0.0003","18.3675","0.0003","104.487","0.001","115.984","0.001","92.985","0.001","5686.82","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H126 Cl4 N24 Ni8 O52.5 -","- C66 H84 Cl4 N24 Ni8 O52.5 -","- C132 H168 Cl8 N48 Ni16 O105 -","2","1","","Pardo, Emilio; Dul, Marie-Claire; Lescouëzec, Rodrigue; Chamoreau, Lise-Marie; Journaux, Yves; Pasán, Jorge; Ruiz-Pérez, Catalina; Julve, Miguel; Lloret, Francesc; Ruiz-García, Rafael; Cano, Joan","Variation of the ground spin state in homo- and hetero-octanuclear copper(ii) and nickel(ii) double-star complexes with a meso-helicate-type metallacryptand core","Dalton Transactions","2010","39","20","4786","","10.1039/b926709c","","","0.71073","MoKα","","0.118","0.0866","","","0.2346","0.2733","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7025295","23.4405","0.0015","19.8751","0.0015","14.5335","0.0015","84.359","0.003","57.542","0.004","38.099","0.016","2759","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H22 Cu N2 Na2 O9 -","- C22 H22 Cu N2 Na2 O9 -","- C88 H88 Cu4 N8 Na8 O36 -","4","2","","Pardo, Emilio; Dul, Marie-Claire; Lescouëzec, Rodrigue; Chamoreau, Lise-Marie; Journaux, Yves; Pasán, Jorge; Ruiz-Pérez, Catalina; Julve, Miguel; Lloret, Francesc; Ruiz-García, Rafael; Cano, Joan","Variation of the ground spin state in homo- and hetero-octanuclear copper(ii) and nickel(ii) double-star complexes with a meso-helicate-type metallacryptand core","Dalton Transactions","2010","39","20","4786","","10.1039/b926709c","","x-ray","0.71073","MoKα","","0.1491","0.062","","","0.1165","0.1427","","","","","","1.003","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7025296","17.426","0.003","17.426","0.003","31.674","0.006","90","","90","","120","","8330","3","293","2","293","2","","","","","","","","8","P -6 c 2","P -6c 2","188","","","","- C84 H150 Cl6 Cu6 N24 Na2 Ni2 O54 -","- C84 H150 Cl6.02 Cu6 N24 Na2 Ni2 O54.08 -","- C168 H300 Cl12.04 Cu12 N48 Na4 Ni4 O108.16 -","2","0.166667","","Pardo, Emilio; Dul, Marie-Claire; Lescouëzec, Rodrigue; Chamoreau, Lise-Marie; Journaux, Yves; Pasán, Jorge; Ruiz-Pérez, Catalina; Julve, Miguel; Lloret, Francesc; Ruiz-García, Rafael; Cano, Joan","Variation of the ground spin state in homo- and hetero-octanuclear copper(ii) and nickel(ii) double-star complexes with a meso-helicate-type metallacryptand core","Dalton Transactions","2010","39","20","4786","","10.1039/b926709c","","","0.7293","","","0.0992","0.097","","","0.2465","0.2504","","","","","","1.173","","","","has coordinates","179958","2020-10-21","18:00:00",""
"7025299","17.7804","0.0006","17.976","0.005","24.1499","0.0007","90","","102.668","0.003","90","","7531","2","180","2","180","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H110 Cu2 Gd2 N4 O14 -","- C70 H110 Cu2 Gd2 N4 O14 -","- C280 H440 Cu8 Gd8 N16 O56 -","4","1","","Costes, Jean-Pierre; Vendier, Laure; Wernsdorfer, Wolfgang","Metalloligands for designing single-molecule and single-chain magnets","Dalton Transactions","2010","39","20","4886","","10.1039/b926739e","","","0.71073","MoKα","","0.0842","0.0341","","","0.0479","0.0544","","","","","","0.788","","","","has coordinates,has disorder","179958","2020-10-21","18:00:00",""
"7025304","30.711","0.004","30.711","0.004","13.202","0.003","90","","90","","90","","12452","4","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C74 H144 Cl4 Mn20 N12 O54 -","- C74 H136 Cl4 Mn20 N12 O54 -","- C296 H544 Cl16 Mn80 N48 O216 -","4","0.25","","Langley, Stuart K.; Moubaraki, Boujemaa; Berry, Kevin J.; Murray, Keith S.","Supertetrahedral icosanuclear and ring-like decanuclear mixed valent manganese(ii/iii) triethanolamine clusters","Dalton Transactions","2010","39","20","4848","","10.1039/b926795f","","","0.77506","synchrotron","","0.0841","0.073","","","0.2049","0.2137","","","","","","1.076","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025305","15.0189","0.0003","16.8546","0.0004","17.5974","0.0004","100.053","0.001","105.133","0.001","99.439","0.001","4129.87","0.16","123","2","123","2","","","","","","","","6","P -1","-P 1","2","work","","","- C172 H202 F8 Mn10 N10 O32 -","- C172 H202 F8 Mn10 N10 O32 -","- C172 H202 F8 Mn10 N10 O32 -","1","0.5","","Langley, Stuart K.; Moubaraki, Boujemaa; Berry, Kevin J.; Murray, Keith S.","Supertetrahedral icosanuclear and ring-like decanuclear mixed valent manganese(ii/iii) triethanolamine clusters","Dalton Transactions","2010","39","20","4848","","10.1039/b926795f","","","0.71073","MoKα","","0.0922","0.0497","","","0.1089","0.1262","","","","","","1.008","","","","has coordinates","179959","2020-10-21","18:00:00",""
"7025306","14.6314","0.0004","20.7821","0.0005","24.1056","0.0006","64.69","0.001","89.462","0.001","77.634","0.001","6444.4","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C122 H146 F8 Mn10 N10 O30 -","- C122 H138 F8 Mn10 N10 O30 -","- C244 H276 F16 Mn20 N20 O60 -","2","1","","Langley, Stuart K.; Moubaraki, Boujemaa; Berry, Kevin J.; Murray, Keith S.","Supertetrahedral icosanuclear and ring-like decanuclear mixed valent manganese(ii/iii) triethanolamine clusters","Dalton Transactions","2010","39","20","4848","","10.1039/b926795f","","","0.71073","MoKα","","0.0972","0.0577","","","0.1567","0.1786","","","","","","1.077","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025326","13.173","0.002","13.384","0.002","11.211","0.002","90","","110.931","0.002","90","","1846.2","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H17 N5 O2 -","- C23 H17 N5 O2 -","- C92 H68 N20 O8 -","4","1","","Craig, Gavin A.; Barrios, Leoní A.; Costa, José Sánchez; Roubeau, Olivier; Ruiz, Eliseo; Teat, Simon J.; Wilson, Chick C.; Thomas, Lynne; Aromí, Guillem","Synthesis of a novel heptacoordinated Fe(iii) dinuclear complex: experimental and theoretical study of the magnetic properties","Dalton Transactions","2010","39","20","4874","","10.1039/b927032a","","","0.7749","synchrotron","","0.0655","0.0522","","","0.139","0.1498","","","","","","1.041","","","","has coordinates","179959","2020-10-21","18:00:00",""
"7025327","11.493","0.003","23.53","0.005","10.094","0.002","90","","109.62","0.03","90","","2571.2","1.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C53 H38 Fe2 N14 O9 S4 -","- C53 H38 Fe2 N14 O9 S4 -","- C106 H76 Fe4 N28 O18 S8 -","2","0.5","","Craig, Gavin A.; Barrios, Leoní A.; Costa, José Sánchez; Roubeau, Olivier; Ruiz, Eliseo; Teat, Simon J.; Wilson, Chick C.; Thomas, Lynne; Aromí, Guillem","Synthesis of a novel heptacoordinated Fe(iii) dinuclear complex: experimental and theoretical study of the magnetic properties","Dalton Transactions","2010","39","20","4874","","10.1039/b927032a","","","0.7514","synchrotron","","0.0773","0.062","","","0.1693","0.1874","","","","","","1.031","","","","has coordinates","179959","2020-10-21","18:00:00",""
"7025370","25.12","0.04","14.64","0.02","24.14","0.05","90","","111.82","0.016","90","","8242","2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","RI2223","","","- C72 H74 Mn6 N6 O24 P2 -","- C72 H74 Mn6 N6 O24 P2 -","- C288 H296 Mn24 N24 O96 P8 -","4","0.5","","Inglis, Ross; Dalgarno, Scott J.; Brechin, Euan K.","A new family of Mn6 SMMs using phosphinate ligands","Dalton Transactions","2010","39","20","4826","","10.1039/b927303d","","","0.71073","MoKα","","0.0602","0.042","","","0.1128","0.1202","","","","","","1.064","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025371","23.14","0.02","12.8","0.02","29.09","0.03","90","","98.571","0.019","90","","8520","18","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","RI2361","","","- C81 H98 Mn6 N6 O27 P2 -","- C81 H98 Mn6 N6 O27 P2 -","- C324 H392 Mn24 N24 O108 P8 -","4","0.5","","Inglis, Ross; Dalgarno, Scott J.; Brechin, Euan K.","A new family of Mn6 SMMs using phosphinate ligands","Dalton Transactions","2010","39","20","4826","","10.1039/b927303d","","","0.71073","MoKα","","0.0698","0.0422","","","0.0909","0.1016","","","","","","1.055","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025372","27.745","0.006","12.618","0.002","27.229","0.008","90","","116.539","0.008","90","","8528","3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","RI2229","","","- C84 H98 Mn6 N6 O24 P2 -","- C84 H98 Mn6 N6 O24 P2 -","- C336 H392 Mn24 N24 O96 P8 -","4","0.5","","Inglis, Ross; Dalgarno, Scott J.; Brechin, Euan K.","A new family of Mn6 SMMs using phosphinate ligands","Dalton Transactions","2010","39","20","4826","","10.1039/b927303d","","","0.71073","MoKα","","0.0598","0.0393","","","0.0833","0.091","","","","","","1.036","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025373","13.79","0.03","14.7","0.03","14.74","0.03","66.78","0.05","71.84","0.06","75.77","0.05","2583","9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","RI2363","","","- C106 H90 Mn6 N6 O22 P2 -","- C106 H90 Mn6 N6 O22 P2 -","- C106 H90 Mn6 N6 O22 P2 -","1","0.5","","Inglis, Ross; Dalgarno, Scott J.; Brechin, Euan K.","A new family of Mn6 SMMs using phosphinate ligands","Dalton Transactions","2010","39","20","4826","","10.1039/b927303d","","","0.71073","MoKα","","0.0626","0.046","","","0.1174","0.1255","","","","","","1.029","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025374","12.954","0.003","12.962","0.003","14.264","0.003","65.467","0.013","80.272","0.014","60.186","0.013","1888.3","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","RI2316","","","- C67 H82 Mn6 N6 O25 P2 -","- C67 H82 Mn6 N6 O25 P2 -","- C67 H82 Mn6 N6 O25 P2 -","1","0.5","","Inglis, Ross; Dalgarno, Scott J.; Brechin, Euan K.","A new family of Mn6 SMMs using phosphinate ligands","Dalton Transactions","2010","39","20","4826","","10.1039/b927303d","","","0.71073","MoKα","","0.0641","0.0433","","","0.0913","0.1011","","","","","","1.027","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025375","12.258","0.017","13.083","0.018","13.767","0.019","98.28","0.04","97.92","0.05","109.2","0.03","2022","5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","RI2317","","","- C74 H98 Mn6 N6 O26 P2 -","- C74 H98 Mn6 N6 O26 P2 -","- C74 H98 Mn6 N6 O26 P2 -","1","0.5","","Inglis, Ross; Dalgarno, Scott J.; Brechin, Euan K.","A new family of Mn6 SMMs using phosphinate ligands","Dalton Transactions","2010","39","20","4826","","10.1039/b927303d","","","0.71073","MoKα","","0.0531","0.0382","","","0.0913","0.0989","","","","","","1.07","","","","has coordinates","179959","2020-10-21","18:00:00",""
"7025389","19.666","0.0015","18.6742","0.0014","36.386","0.003","90","","99.483","0.001","90","","13180","1.8","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- H72 Na16 O116 Pd30 Se21 -","- Na16 O116 Pd30 Se21 -","- Na64 O464 Pd120 Se84 -","4","1","","Delferro, Massimiliano; Graiff, Claudia; Elviri, Lisa; Predieri, Giovanni","Self-assembly of polyoxoselenitopalladate nanostars [Pd~15~(μ~3~-SeO~3~)~10~(μ~3~-O)~10~Na]^9-^ and their supramolecular pairing in the solid state","Dalton Transactions","2010","39","19","4479","4481","10.1039/b927537a","","","0.71073","MoKα","","0.0262","0.0214","","","0.0375","0.0379","","","","","","0.798","","","","has coordinates","218737","2020-10-21","18:00:00",""
"7025391","12.7727","0.0014","13.6246","0.0015","16.6712","0.0018","72.353","0.002","70.913","0.002","72.982","0.002","2551.6","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H136 Co6 N14 O69 Y4 -","- C52 H106 Co6 N14 O69 Y4 -","- C52 H106 Co6 N14 O69 Y4 -","1","0.5","","Xiang, Hua; Lan, Yanhua; Li, Huan-Yong; Jiang, Long; Lu, Tong-Bu; Anson, Christopher E.; Powell, Annie K.","Novel mixed-valent CoII2CoIII4LnIII4 aggregates with ligands derived from tris-(hydroxymethyl)aminomethane (Tris)","Dalton Transactions","2010","39","20","4737","","10.1039/c000008f","","","0.71073","MoKα","","0.0805","0.0553","","","0.1483","0.1634","","","","","","1.033","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025392","12.8831","0.0006","13.6555","0.0005","16.0874","0.0006","72.486","0.003","71.881","0.004","73.986","0.004","2512.73","0.19","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H124 Co6 Gd4 N14 O65 -","- C50 H95 Co6 Gd4 N14 O65 -","- C50 H95 Co6 Gd4 N14 O65 -","1","0.5","","Xiang, Hua; Lan, Yanhua; Li, Huan-Yong; Jiang, Long; Lu, Tong-Bu; Anson, Christopher E.; Powell, Annie K.","Novel mixed-valent CoII2CoIII4LnIII4 aggregates with ligands derived from tris-(hydroxymethyl)aminomethane (Tris)","Dalton Transactions","2010","39","20","4737","","10.1039/c000008f","","","1.54178","CuKα","","0.1166","0.0594","","","0.1159","0.1268","","","","","","0.972","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025393","12.8569","0.0015","13.6424","0.0016","16.3608","0.0019","72.386","0.002","71.502","0.002","73.644","0.002","2538.5","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H126 Co6 Dy4 N14 O66 -","- C50 H98 Co6 Dy4 N14 O66 -","- C50 H98 Co6 Dy4 N14 O66 -","1","0.5","","Xiang, Hua; Lan, Yanhua; Li, Huan-Yong; Jiang, Long; Lu, Tong-Bu; Anson, Christopher E.; Powell, Annie K.","Novel mixed-valent CoII2CoIII4LnIII4 aggregates with ligands derived from tris-(hydroxymethyl)aminomethane (Tris)","Dalton Transactions","2010","39","20","4737","","10.1039/c000008f","","","0.71073","MoKα","","0.0849","0.0615","","","0.1669","0.1899","","","","","","1.07","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025396","16.2223","0.001","17.4252","0.001","17.9369","0.001","65.431","0.004","66.114","0.004","66.993","0.004","4062.6","0.4","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C150 H154 Dy6 Mn4 N10 O54 -","- C150 H154 Dy6 Mn4 N10 O54 -","- C150 H154 Dy6 Mn4 N10 O54 -","1","0.5","","Majeed, Zeeshan; Mondal, Kartik C.; Kostakis, George E.; Lan, Yanhua; Anson, Christopher E.; Powell, Annie K.","Structure and magnetic properties of a decanuclear MnII2MnIII2Dy6 aggregate","Dalton Transactions","2010","39","20","4740","","10.1039/c000082e","","","0.71073","MoKα","","0.0618","0.0424","","","0.0952","0.1015","","","","","","1.061","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025408","11.968","0.002","12.369","0.003","14.349","0.003","97.2","0.03","112.67","0.03","101.36","0.03","1873.5","0.9","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C64 H58 Cl4 Cu2 Mn4 N12 O30 -","- C64 H58 Cl4 Cu2 Mn4 N12 O30 -","- C64 H58 Cl4 Cu2 Mn4 N12 O30 -","1","0.5","","Jeon, Ie-Rang; Ababei, Rodica; Lecren, Lollita; Li, Yang-Guang; Wernsdorfer, Wolfgang; Roubeau, Olivier; Mathonière, Corine; Clérac, Rodolphe","Two-dimensional assembly of [MnIII2MnII2] single-molecule magnets and [Cu(pic)2] linking units (Hpic = picolinic acid)","Dalton Transactions","2010","39","20","4744","","10.1039/c000311e","","","0.71073","MoKα","","0.074","0.0479","","","0.1219","0.1388","","","","","","0.941","","","","has coordinates","179960","2020-10-21","18:00:00",""
"7025492","8.2756","0.0002","8.8185","0.0002","19.8387","0.0005","90","","99.4107","0.0008","90","","1428.31","0.06","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 Cl2 N4 O Pt -","- C11 H10 Cl2 N4 O Pt -","- C44 H40 Cl8 N16 O4 Pt4 -","4","1","","Marqués-Gallego, Patricia; Gamiz-Gonzalez, M. Amparo; Fortea-Pérez, Francisco R.; Lutz, Martin; Spek, Anthony L.; Pevec, Andrej; Kozlevčar, Bojan; Reedijk, Jan","Quinoxaline-2-carboxamide as a carrier ligand in two new platinum(ii) compounds: Synthesis, crystal structure, cytotoxic activity and DNA interaction","Dalton Transactions","2010","39","21","5152","","10.1039/c001158d","","","0.71073","MoKα","","0.0481","0.0337","","","0.0786","0.0849","","","","","","1.013","","","","has coordinates","179960","2020-10-21","18:00:00",""
"7025493","10.3211","0.0003","18.9564","0.0007","7.0183","0.0002","90","","105.028","0.001","90","","1326.17","0.07","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 Cl N3 O2 Pt S -","- C11 H12 Cl N3 O2 Pt S -","- C44 H48 Cl4 N12 O8 Pt4 S4 -","4","1","","Marqués-Gallego, Patricia; Gamiz-Gonzalez, M. Amparo; Fortea-Pérez, Francisco R.; Lutz, Martin; Spek, Anthony L.; Pevec, Andrej; Kozlevčar, Bojan; Reedijk, Jan","Quinoxaline-2-carboxamide as a carrier ligand in two new platinum(ii) compounds: Synthesis, crystal structure, cytotoxic activity and DNA interaction","Dalton Transactions","2010","39","21","5152","","10.1039/c001158d","","","0.71073","MoKα","","0.0431","0.0323","","","0.0774","0.0824","","","","","","1.099","","","","has coordinates","179960","2020-10-21","18:00:00",""
"7025623","15.716","0.003","26.662","0.005","23.563","0.005","90","","97.66","0.03","90","","9785","3","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H120 Gd6 N6 Ni3 O84 P6 -","- C30 H36 Gd6 N6 Ni3 O59 P6 -","- C120 H144 Gd24 N24 Ni12 O236 P24 -","4","1","","Zhuang, Gui-Lin; Jin, Yi-Chang; Zhao, Hai-Xia; Kong, Xiang-Jian; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","A nanosized Gd6Ni3 cluster-based heterometallic coordination polymer","Dalton Transactions","2010","39","21","5077","","10.1039/c002319a","","","0.71073","MoKα","","0.0886","0.074","","","0.1892","0.2001","","","","","","1.009","","","","has coordinates","179962","2020-10-21","18:00:00",""
"7025625","14.25","0.003","34.26","0.007","14.65","0.003","90","","114.82","0.03","90","","6492","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H152 Dy8 Mn9 N17 O87 -","- C56 H108 Dy8 Mn9 N17 O87 -","- C112 H216 Dy16 Mn18 N34 O174 -","2","0.5","","Langley, Stuart K.; Moubaraki, Boujemaa; Murray, Keith S.","A heptadecanuclear MnIII9DyIII8 cluster derived from triethanolamine with two edge sharing supertetrahedra as the core and displaying SMM behaviour","Dalton Transactions","2010","39","21","5066","","10.1039/c002372h","","","0.77508","synchrotron","","0.0701","0.0584","","","0.1579","0.1669","","","","","","1.031","","","","has coordinates,has disorder","179962","2020-10-21","18:00:00",""
"7025702","16.3135","0.0004","27.1846","0.0007","19.8699","0.0006","90","","112.299","0.001","90","","8152.8","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C86 H112 N4 O4 Zr -","- C86 H112 N4 O4 Zr -","- C344 H448 N16 O16 Zr4 -","4","1","","Saha, Tanmoy Kumar; Rajashekhar, Bijja; Gowda, Ravikumar R.; Ramkumar, Venkatachalam; Chakraborty, Debashis","Bis(imino)phenoxide complexes of zirconium: synthesis, structural characterization and solvent-free ring-opening polymerization of cyclic esters and lactides","Dalton Transactions","2010","39","21","5091","","10.1039/c002875d","","","0.71073","MoKα","","0.2079","0.084","","","0.2454","0.3224","","","","","","0.973","","","","has coordinates","179963","2020-10-21","18:00:00",""
"7025858","3.8403","0.0001","14.0971","0.0004","16.92","0.0005","90","","90.269","0.002","90","","915.99","0.04","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 B Cl N2 -","- C10 H8 B Cl N2 -","- C40 H32 B4 Cl4 N8 -","4","1","","Mansell, Stephen M.; Norman, Nicholas C.; Russell, Christopher A.","Boron‒nitrogen analogues of the fluorenyl anion","Dalton Transactions","2010","39","21","5084","","10.1039/c0dt00028k","","","0.71073","MoKα","","0.0368","0.0298","","","0.0722","0.0761","","","","","","1.07","","","","has coordinates","179964","2020-10-21","18:00:00",""
"7025859","20.144","0.002","17.323","0.0019","7.1036","0.0007","90","","93.577","0.002","90","","2474","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 B N2 -","- C16 H13 B N2 -","- C128 H104 B8 N16 -","8","2","","Mansell, Stephen M.; Norman, Nicholas C.; Russell, Christopher A.","Boron‒nitrogen analogues of the fluorenyl anion","Dalton Transactions","2010","39","21","5084","","10.1039/c0dt00028k","","","0.71073","MoKα","","0.0708","0.0414","","","0.0928","0.1055","","","","","","1.004","","","","has coordinates","179964","2020-10-21","18:00:00",""
"7026037","13.512","0.002","20.928","0.003","27.872","0.004","90","","102.544","0.003","90","","7693.5","1.9","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C93 H92 Li4 N4 P4 -","- C93 H92 Li4 N4 P4 -","- C372 H368 Li16 N16 P16 -","4","1","","Cooper, Oliver J.; McMaster, Jonathan; Lewis, William; Blake, Alexander J.; Liddle, Stephen T.","Synthesis and structure of [U{C(PPh2NMes)2}2] (Mes = 2,4,6-Me3C6H2): A homoleptic uranium bis(carbene) complex with two formal UC double bonds","Dalton Transactions","2010","39","21","5074","","10.1039/c0dt00152j","","","0.71073","MoKα","","0.1566","0.0765","","","0.1476","0.179","","","","","","0.995","","","","has coordinates","179966","2020-10-21","18:00:00",""
"7026038","14.839","0.002","15.329","0.002","21.677","0.003","70.551","0.002","75.047","0.003","77.427","0.003","4444.8","1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C114 H116 N4 P4 U -","- C86 H84 N4 P4 U -","- C172 H168 N8 P8 U2 -","2","1","","Cooper, Oliver J.; McMaster, Jonathan; Lewis, William; Blake, Alexander J.; Liddle, Stephen T.","Synthesis and structure of [U{C(PPh2NMes)2}2] (Mes = 2,4,6-Me3C6H2): A homoleptic uranium bis(carbene) complex with two formal UC double bonds","Dalton Transactions","2010","39","21","5074","","10.1039/c0dt00152j","","","0.71073","MoKα","","0.0881","0.0742","","","0.1892","0.1984","","","","","","1.024","","","","has coordinates","179966","2020-10-21","18:00:00",""
"7026213","15.8632","0.0006","15.8632","0.0006","28.772","0.002","90","","90","","120","","6270.2","0.5","295","2","295","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C18 H43 Na6 O36.5 Pd3 -","- C18 H42 Na6 O36.5 Pd3 -","- C108 H252 Na36 O219 Pd18 -","6","0.333333","","Gunari, Parag; s/o Krishnasamy, Suresh; Bai, Shi-Qiang; Hor, T. S. Andy","Crystallographic identification of an unusual homoleptic palladium citrate [Na(OH2)6]·{[Na3(OH2)8]3[NaPd3(C6H4O7)3]2}·(H2O) stabilised by intermetallic aggregation with sodium and heavy hydration","Dalton Transactions","2010","39","40","9462","","10.1039/c0dt00273a","","","0.71073","MoKα","","0.0625","0.0579","","","0.1106","0.1123","","","","","","1.302","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027935","17.398","0.008","7.379","0.003","11.634","0.005","90","","103.95","0.01","90","","1449.5","1.1","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 Mn O6 -","- C16 H9 Mn O6 -","- C64 H36 Mn4 O24 -","4","1","","Splith, Katrin; Neundorf, Ines; Hu, Wanning; N'Dongo, Harmel W. Peindy; Vasylyeva, Vera; Merz, Klaus; Schatzschneider, Ulrich","Influence of the metal complex-to-peptide linker on the synthesis and properties of bioactive CpMn(CO)3 peptide conjugates","Dalton Transactions","2010","39","10","2536","2545","10.1039/b916907e","","","0.71073","MoKα","","0.0638","0.0564","","","0.1365","0.1433","","","","","","1.135","","","","has coordinates","179985","2020-10-21","18:00:00",""
"7027936","6.435","0.003","19.001","0.009","10.92","0.006","90","","100.964","0.009","90","","1310.8","1.1","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 Mn O6 -","- C13 H11 Mn O6 -","- C52 H44 Mn4 O24 -","4","1","","Splith, Katrin; Neundorf, Ines; Hu, Wanning; N'Dongo, Harmel W. Peindy; Vasylyeva, Vera; Merz, Klaus; Schatzschneider, Ulrich","Influence of the metal complex-to-peptide linker on the synthesis and properties of bioactive CpMn(CO)3 peptide conjugates","Dalton Transactions","2010","39","10","2536","2545","10.1039/b916907e","","","0.71073","MoKα","","0.051","0.0475","","","0.1203","0.1226","","","","","","1.134","","","","has coordinates","179985","2020-10-21","18:00:00",""
"7027937","11.745","0.002","10.67","0.002","13.424","0.003","90","","113.63","0.03","90","","1541.2","0.6","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 Mn O6 -","- C16 H9 Mn O6 -","- C64 H36 Mn4 O24 -","4","1","","Splith, Katrin; Neundorf, Ines; Hu, Wanning; N'Dongo, Harmel W. Peindy; Vasylyeva, Vera; Merz, Klaus; Schatzschneider, Ulrich","Influence of the metal complex-to-peptide linker on the synthesis and properties of bioactive CpMn(CO)3 peptide conjugates","Dalton Transactions","2010","39","10","2536","2545","10.1039/b916907e","","","0.71073","MoKα","","0.0647","0.0556","","","0.1409","0.1486","","","","","","1.112","","","","has coordinates","179985","2020-10-21","18:00:00",""
"7027938","6.364","0.0012","7.0047","0.0013","18.316","0.003","90.874","0.006","97.733","0.005","114.416","0.004","734.4","0.2","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H9 Mn O6 -","- C16 H9 Mn O6 -","- C32 H18 Mn2 O12 -","2","1","","Splith, Katrin; Neundorf, Ines; Hu, Wanning; N'Dongo, Harmel W. Peindy; Vasylyeva, Vera; Merz, Klaus; Schatzschneider, Ulrich","Influence of the metal complex-to-peptide linker on the synthesis and properties of bioactive CpMn(CO)3 peptide conjugates","Dalton Transactions","2010","39","10","2536","2545","10.1039/b916907e","","","0.71073","MoKα","","0.0951","0.0828","","","0.2196","0.2333","","","","","","1.019","","","","has coordinates","179985","2020-10-21","18:00:00",""
"7027939","9.5428","0.0005","15.5173","0.0007","16.924","0.001","80.039","0.004","81.081","0.004","89.874","0.003","2437.7","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C14 H38 Cl0.5 Cu N4 Na0.5 O10 P2 -","- C14 H34 Cl0.5 Cu N4 Na0.5 O10 P2 -","- C56 H136 Cl2 Cu4 N16 Na2 O40 P8 -","4","2","","Stigers, Dannon J.; Ferdani, Riccardo; Weisman, Gary R.; Wong, Edward H.; Anderson, Carolyn J.; Golen, James A.; Moore, Curtis; Rheingold, Arnold L.","A new phosphonate pendant-armed cross-bridged tetraamine chelator accelerates copper(ii) binding for radiopharmaceutical applications","Dalton Transactions","2010","39","7","1699","1701","10.1039/b920871b","","","1.54178","CuKα","","0.1215","0.0665","","","0.1731","0.2045","","","","","","1.041","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027940","11.5219","0.0016","11.7468","0.0016","9.6554","0.0013","90","","115.254","0.003","90","","1181.9","0.3","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C14 H41 Cl N4 O10 P2 -","- C14 H41 Cl N4 O10 P2 -","- C28 H82 Cl2 N8 O20 P4 -","2","0.5","","Stigers, Dannon J.; Ferdani, Riccardo; Weisman, Gary R.; Wong, Edward H.; Anderson, Carolyn J.; Golen, James A.; Moore, Curtis; Rheingold, Arnold L.","A new phosphonate pendant-armed cross-bridged tetraamine chelator accelerates copper(ii) binding for radiopharmaceutical applications","Dalton Transactions","2010","39","7","1699","1701","10.1039/b920871b","","","0.71073","MoKα","","0.0358","0.0333","","","0.0805","0.0817","","","","","","1.066","","","","has coordinates","179985","2020-10-21","18:00:00",""
"7027941","15.315","0.002","20.473","0.003","11.6852","0.0016","90","","113.839","0.002","90","","3351.2","0.8","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C39 H46 Ge -","- C39 H46 Ge -","- C156 H184 Ge4 -","4","0.5","","Ghereg, Dumitru; Gornitzka, Heinz; Ranaivonjatovo, Henri; Escudié, Jean","Reactions of germenes with various naphthoquinones controlled by substituent effects","Dalton Transactions","2010","39","8","2016","2022","10.1039/b921729k","","","0.71073","MoKα","","0.0749","0.0436","","","0.0872","0.0971","","","","","","0.998","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7027942","11.3584","0.0003","14.297","0.0004","20.0687","0.0005","74.574","0.002","81.44","0.002","72.261","0.002","2984.03","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C75.5 H74 Ge2 O5 -","- C75.5 H74 Ge2 O5 -","- C151 H148 Ge4 O10 -","2","1","","Ghereg, Dumitru; Gornitzka, Heinz; Ranaivonjatovo, Henri; Escudié, Jean","Reactions of germenes with various naphthoquinones controlled by substituent effects","Dalton Transactions","2010","39","8","2016","2022","10.1039/b921729k","","","0.71073","MoKα","","0.0898","0.0442","","","0.0933","0.1084","","","","","","0.964","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7027943","17.3042","0.0017","25.114","0.002","19.401","0.002","90","","112.691","0.002","90","","7778.7","1.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C89 H100 Cl2 Ge2 O2 -","- C89 H100 Cl2 Ge2 O2 -","- C356 H400 Cl8 Ge8 O8 -","4","1","","Ghereg, Dumitru; Gornitzka, Heinz; Ranaivonjatovo, Henri; Escudié, Jean","Reactions of germenes with various naphthoquinones controlled by substituent effects","Dalton Transactions","2010","39","8","2016","2022","10.1039/b921729k","","","0.71073","MoKα","","0.1778","0.0725","","","0.1279","0.1625","","","","","","0.975","","","","has coordinates,has disorder","179985","2020-10-21","18:00:00",""
"7027944","12.547","0.0006","17.4292","0.0008","19.4232","0.0011","95.521","0.002","93.11","0.003","108.741","0.003","3987.3","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C94 H112 Ge2 O3 -","- C94 H112 Ge2 O3 -","- C188 H224 Ge4 O6 -","2","1","","Ghereg, Dumitru; Gornitzka, Heinz; Ranaivonjatovo, Henri; Escudié, Jean","Reactions of germenes with various naphthoquinones controlled by substituent effects","Dalton Transactions","2010","39","8","2016","2022","10.1039/b921729k","","","0.71073","MoKα","","0.258","0.068","","","0.0859","0.1266","","","","","","0.703","","","","has coordinates,has disorder","179985","2020-10-21","18:00:00",""
"7027945","9.6539","0.0012","10.7179","0.0012","28.37","0.004","92.826","0.012","99.512","0.011","90.753","0.017","2890.9","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C61 H62.81 Br1.19 Mg N6 O2 -","- C61 H62.8134 Br1.1866 Mg N6 O2 -","- C122 H125.627 Br2.3732 Mg2 N12 O4 -","2","1","","Suijkerbuijk, Bart M. J. M.; Schamhart, Daniël J.; Kooijman, Huub; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","Mono(NCN-pincer palladium)-metalloporphyrin catalysts: evidence for supramolecular bimetallic catalysis","Dalton Transactions","2010","39","27","6198","6216","10.1039/b925236n","","","0.71073","MoKα","","0.1335","0.0842","","","0.2144","0.2381","","","","","","1.039","","","","has coordinates,has disorder","179985","2020-10-21","18:00:00",""
"7027946","9.5146","0.0003","9.5146","0.0003","22.109","0.0009","90","","90","","120","","1733.33","0.1","150","2","150","2","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled to 150K at a rate of 120 Khr^-1^ for single-crystal X-ray diffraction analysis.","","","3","R 3 2 :H","R 3 2""","155","U(Pn*)2","U(Pn*)2","","- C28 H36 U -","- C27.72 H35.64 U -","- C83.16 H106.92 U3 -","3","0.166667","","Chadwick, F. Mark; Ashley, Andrew; Wildgoose, Gregory; Goicoechea, Jose M.; Randall, Simon; O'Hare, Dermot","Bis(permethylpentalene)uranium","Dalton Transactions","2010","39","29","6789","6793","10.1039/c0dt00012d","","","0.71073","MoKα","","0.0313","0.0313","","","0.073","0.073","","","","","","1.091","","","","has coordinates","179985","2020-10-21","18:00:00",""
"7027947","18.5636","0.0003","18.5636","0.0003","19.7224","0.0006","90","","90","","120","","5885.9","0.2","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H18.64 Cu N4 O7.32 -","- C24 H18.64 Cu N4 O7.32 -","- C216 H167.76 Cu9 N36 O65.88 -","9","0.5","","Wang, Xiuli; Lin, Hongyan; Mu, Bao; Tian, Aixiang; Liu, Guocheng","Encapsulation of discrete (H2O)12 clusters in a 3D three-fold interpenetrating metal‒organic framework host with (3,4)-connected topology","Dalton Transactions","2010","39","27","6187","6189","10.1039/c0dt00302f","","","0.71073","MoKα","","0.043","0.0348","","","0.0992","0.1143","","","","","","1.181","","","","has coordinates","201370","2020-10-21","18:00:00",""
"7030424","12.9874","0.001","15.0728","0.0011","17.0321","0.001","90","","90","","90","","3334.1","0.4","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C25 H20 Cu Fe N8 O11 Tb -","- C25 H20 Cu Fe N8 O11 Tb -","- C100 H80 Cu4 Fe4 N32 O44 Tb4 -","4","1","","Gheorghe, Ruxandra; Madalan, Augustin M.; Costes, Jean-Pierre; Wernsdorfer, Wolfgang; Andruh, Marius","A heterotrimetallic 3d‒3d′‒4f single chain magnet constructed from anisotropic high-spin 3d‒4f nodes and paramagnetic spacers","Dalton Transactions","2010","39","20","4734","","10.1039/b925636a","","","0.71073","MoKα","","0.0673","0.0391","","","0.0699","0.0763","","","","","","0.967","","","","has coordinates","180010","2020-10-21","18:00:00",""
"7030425","15.3013","0.0002","20.5209","0.0003","22.6575","0.0004","90","","105.363","0.001","90","","6860.15","0.18","180","2","180","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C65 H72 Cl2 Cu Gd N9 O21 -","- C65 H72 Cl2 Cu Gd N9 O21 -","- C260 H288 Cl8 Cu4 Gd4 N36 O84 -","4","1","","Georgopoulou, Anastasia N.; Adam, Rosa; Raptopoulou, Catherine P.; Psycharis, Vassilis; Ballesteros, Rafael; Abarca, Belén; Boudalis, Athanassios K.","Isomorphous replacement of MII ions in MII‒GdIII dimers (MII = CuII, MnII, NiII, CoII, ZnII): magnetic studies of the products","Dalton Transactions","2010","39","20","5020","","10.1039/b925525g","","","1.54178","CuKα","","0.0435","0.0405","","","0.0899","0.0924","","","","","","1.032","","","","has coordinates,has disorder","180010","2020-10-21","18:00:00",""
"7030426","15.2166","0.0002","20.4545","0.0003","22.7423","0.0004","90","","105.032","0.001","90","","6836.28","0.18","160","2","160","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C65 H72 Cl2 Gd N9 Ni O21 -","- C65 H72 Cl2 Gd N9 Ni O21 -","- C260 H288 Cl8 Gd4 N36 Ni4 O84 -","4","1","","Georgopoulou, Anastasia N.; Adam, Rosa; Raptopoulou, Catherine P.; Psycharis, Vassilis; Ballesteros, Rafael; Abarca, Belén; Boudalis, Athanassios K.","Isomorphous replacement of MII ions in MII‒GdIII dimers (MII = CuII, MnII, NiII, CoII, ZnII): magnetic studies of the products","Dalton Transactions","2010","39","20","5020","","10.1039/b925525g","","","1.54178","CuKα","","0.0808","0.069","","","0.1454","0.1607","","","","","","1.01","","","","has coordinates,has disorder","180010","2020-10-21","18:00:00",""
"7030427","15.338","0.002","20.491","0.002","23.225","0.003","90","","106.096","0.007","90","","7013.3","1.5","180","2","180","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C65 H72 Cl2 Gd Mn N9 O21 -","- C65 H72 Cl2 Gd Mn N9 O21 -","- C260 H288 Cl8 Gd4 Mn4 N36 O84 -","4","1","","Georgopoulou, Anastasia N.; Adam, Rosa; Raptopoulou, Catherine P.; Psycharis, Vassilis; Ballesteros, Rafael; Abarca, Belén; Boudalis, Athanassios K.","Isomorphous replacement of MII ions in MII‒GdIII dimers (MII = CuII, MnII, NiII, CoII, ZnII): magnetic studies of the products","Dalton Transactions","2010","39","20","5020","","10.1039/b925525g","","","1.54178","CuKα","","0.0497","0.0459","","","0.1085","0.1132","","","","","","1.044","","","","has coordinates,has disorder","180010","2020-10-21","18:00:00",""
"9017441","5.3528","","7.2896","","5.1187","","109.359","","97.733","","106.359","","174.984","","","","","","","","","","","","Synthetic","5","P -1","-P 1","2","","","Tavorite","- Fe H Li O5 P -","- Fe H Li O5 P -","- Fe2 H2 Li2 O10 P2 -","2","1","","Marx, N.; Croguennec, L.; Carlier, D.; Wattiaux, A.; Le Cras, F.; Suard, E.; Delmas, C.","The structure of tavorite LiFePO4(OH) from diffraction and GGA + U studies and its preliminary electrochemical characterization","Dalton Transactions","2010","39","","5108","5116","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""