# Search results of SQL query from the Crystallography Open Database # Date and time performed: 2026-01-24T11:37:47+01:00 # Query: # SELECT data.* # FROM # data JOIN jaltnames # ON altname = journal # WHERE # (status is null or status != 'retracted') and # (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Dalton Transactions') AND volume = 42 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 "7020725","10.094","0.003","18.751","0.006","14.086","0.005","90","","100.51","0.006","90","","2621.4","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H42 Fe O3 P4 -","- C20 H42 Fe O3 P4 -","- C80 H168 Fe4 O12 P16 -","4","1","","Xu, Xiaofeng; Jia, Jiong; Sun, Hongjian; Liu, Yuxia; Xu, Wengang; Shi, Yujie; Zhang, Dongju; Li, Xiaoyan","Selective activation of C‒F and C‒H bonds with iron complexes, the relevant mechanism study by DFT calculations and study on the chemical properties of hydrido iron complex","Dalton Transactions","2013","42","10","3417","","10.1039/c2dt31795h","","","0.71073","MoKα","","0.0626","0.0393","","","0.0881","0.0959","","","","","","0.914","","","","has coordinates","179912","2020-10-21","18:00:00","" "7020726","9.661","0.002","21.657","0.005","15.892","0.004","90","","102.072","0.004","90","","3251.5","1.3","273","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H44 F2 Fe N P3 Si -","- C27 H44 F2 Fe N P3 Si -","- C108 H176 F8 Fe4 N4 P12 Si4 -","4","1","","Xu, Xiaofeng; Jia, Jiong; Sun, Hongjian; Liu, Yuxia; Xu, Wengang; Shi, Yujie; Zhang, Dongju; Li, Xiaoyan","Selective activation of C‒F and C‒H bonds with iron complexes, the relevant mechanism study by DFT calculations and study on the chemical properties of hydrido iron complex","Dalton Transactions","2013","42","10","3417","","10.1039/c2dt31795h","","","0.71073","MoKα","","0.0829","0.0436","","","0.0894","0.1039","","","","","","1.024","","","","has coordinates","179912","2020-10-21","18:00:00","" "7020727","9.6343","0.0008","9.3988","0.0008","33.449","0.003","90","","92.814","0.002","90","","3025.2","0.5","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H34 F2 Fe O2 P2 -","- C32 H34 F2 Fe O2 P2 -","- C128 H136 F8 Fe4 O8 P8 -","4","1","","Xu, Xiaofeng; Jia, Jiong; Sun, Hongjian; Liu, Yuxia; Xu, Wengang; Shi, Yujie; Zhang, Dongju; Li, Xiaoyan","Selective activation of C‒F and C‒H bonds with iron complexes, the relevant mechanism study by DFT calculations and study on the chemical properties of hydrido iron complex","Dalton Transactions","2013","42","10","3417","","10.1039/c2dt31795h","","","0.71073","MoKα","","0.1081","0.0513","","","0.116","0.1479","","","","","","0.97","","","","has coordinates,has disorder","179912","2020-10-21","18:00:00","" "7020728","9.3","0.007","11.375","0.009","13.62","0.01","66.927","0.011","79.162","0.013","74.851","0.013","1273.5","1.7","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H36 F2 Fe N P3 -","- C22 H36 F2 Fe N P3 -","- C44 H72 F4 Fe2 N2 P6 -","2","1","","Xu, Xiaofeng; Jia, Jiong; Sun, Hongjian; Liu, Yuxia; Xu, Wengang; Shi, Yujie; Zhang, Dongju; Li, Xiaoyan","Selective activation of C‒F and C‒H bonds with iron complexes, the relevant mechanism study by DFT calculations and study on the chemical properties of hydrido iron complex","Dalton Transactions","2013","42","10","3417","","10.1039/c2dt31795h","","","0.71073","MoKα","","0.0574","0.0466","","","0.1216","0.1298","","","","","","1.014","","","","has coordinates","179912","2020-10-21","18:00:00","" "7020729","13.432","0.003","12.134","0.003","33.252","0.007","90","","90","","90","","5420","2","273","2","273","2","","","","","","","","7","C m c a","-C 2ac 2","64","","","","- C22 H35 Br F2 Fe N P3 -","- C22 H35 Br F2 Fe N P3 -","- C176 H280 Br8 F16 Fe8 N8 P24 -","8","","","Xu, Xiaofeng; Jia, Jiong; Sun, Hongjian; Liu, Yuxia; Xu, Wengang; Shi, Yujie; Zhang, Dongju; Li, Xiaoyan","Selective activation of C‒F and C‒H bonds with iron complexes, the relevant mechanism study by DFT calculations and study on the chemical properties of hydrido iron complex","Dalton Transactions","2013","42","10","3417","","10.1039/c2dt31795h","","","0.71073","MoKα","","0.0833","0.0625","","","0.1763","0.1952","","","","","","1.045","","","","has coordinates,has disorder","179912","2020-10-21","18:00:00","" "7020730","13.492","0.007","12.097","0.006","34.022","0.017","90","","90","","90","","5553","5","298","2","298","2","","","","","","","","7","C m c a","-C 2ac 2","64","","","","- C22 H35 F2 Fe I N P3 -","- C22 H35 F2 Fe I N P3 -","- C176 H280 F16 Fe8 I8 N8 P24 -","8","","","Xu, Xiaofeng; Jia, Jiong; Sun, Hongjian; Liu, Yuxia; Xu, Wengang; Shi, Yujie; Zhang, Dongju; Li, Xiaoyan","Selective activation of C‒F and C‒H bonds with iron complexes, the relevant mechanism study by DFT calculations and study on the chemical properties of hydrido iron complex","Dalton Transactions","2013","42","10","3417","","10.1039/c2dt31795h","","","0.71073","MoKα","","0.1667","0.0532","","","0.1121","0.1639","","","","","","0.842","","","","has coordinates,has disorder","179912","2020-10-21","18:00:00","" "7020806","11.9996","0.001","25.732","0.002","23.7294","0.0019","90","","98.966","0.001","90","","7237.5","1","185","2","185","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C27 H29 Cl2 Cu4 N4 Na O19 -","- C27 H29 Cl2 Cu4 N4 Na O19 -","- C216 H232 Cl16 Cu32 N32 Na8 O152 -","8","1","","Zhang, Xiaoying; Li, Bo; Tang, Jinkui; Tian, Jumei; Huang, Guolong; Zhang, Jingping","Tuning the interactions from antiferro- to ferro-magnetic by molecular tailoring and manipulating","Dalton Transactions","2013","42","10","3308","","10.1039/c2dt32021e","","","0.71073","MoKα","","0.0974","0.0598","","","0.131","0.1469","","","","","","1.172","","","","has coordinates,has disorder","179913","2020-10-21","18:00:00","" "7020807","11.9615","0.0014","23.642","0.003","12.8979","0.0015","90","","102.362","0.002","90","","3562.9","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H66 Cl2 Cu8 N8 O28 -","- C60 H66 Cl2 Cu8 N8 O28 -","- C120 H132 Cl4 Cu16 N16 O56 -","2","0.5","","Zhang, Xiaoying; Li, Bo; Tang, Jinkui; Tian, Jumei; Huang, Guolong; Zhang, Jingping","Tuning the interactions from antiferro- to ferro-magnetic by molecular tailoring and manipulating","Dalton Transactions","2013","42","10","3308","","10.1039/c2dt32021e","","","0.71073","MoKα","","0.0964","0.0528","","","0.1156","0.1348","","","","","","1.007","","","","has coordinates,has disorder","301848","2025-08-21","12:23:37","" "7020808","22.645","","28.612","","13.161","","90","","90","","90","","8527.26","","185","2","185","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C14 H17 Cl2 Cu2 N3 O11 -","- C14 H17 Cl2 Cu2 N3 O11 -","- C224 H272 Cl32 Cu32 N48 O176 -","16","1","","Zhang, Xiaoying; Li, Bo; Tang, Jinkui; Tian, Jumei; Huang, Guolong; Zhang, Jingping","Tuning the interactions from antiferro- to ferro-magnetic by molecular tailoring and manipulating","Dalton Transactions","2013","42","10","3308","","10.1039/c2dt32021e","","","0.71073","MoKα","","0.0793","0.0574","","","0.1406","0.1531","","","","","","1.129","","","","has coordinates,has disorder","301848","2025-08-21","12:23:37","" "7020809","21.9919","0.0018","13.5763","0.0005","16.966","0.002","90","","120.092","0.014","90","","4382.8","0.9","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H19 Cl Cu2 N2 O11 -","- C14 H19 Cl Cu2 N2 O11 -","- C112 H152 Cl8 Cu16 N16 O88 -","8","1","","Zhang, Xiaoying; Li, Bo; Tang, Jinkui; Tian, Jumei; Huang, Guolong; Zhang, Jingping","Tuning the interactions from antiferro- to ferro-magnetic by molecular tailoring and manipulating","Dalton Transactions","2013","42","10","3308","","10.1039/c2dt32021e","","","0.71073","MoKα","","0.0628","0.0409","","","0.1105","0.1146","","","","","","0.928","","","","has coordinates,has disorder","301848","2025-08-21","12:23:37","" "7020845","7.541","0.0014","11.291","0.002","27.486","0.005","90","","95.942","0.008","90","","2327.7","0.7","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H19 B Br F2 N3 S2 -","- C22 H19 B Br F2 N3 S2 -","- C88 H76 B4 Br4 F8 N12 S8 -","4","1","","Singh, Atul P.; Murale, Dhiraj P.; Ha, Yonghwang; Liew, Hyunjeong; Lee, Kang Mun; Segev, Aviv; Suh, Yoo-Hun; Churchill, David G.","A novel, selective, and extremely responsive thienyl-based dual fluorogenic probe for tandem superoxide and Hg2+ chemosensing","Dalton Transactions","2013","42","10","3285","","10.1039/c2dt32135a","","","0.71073","MoKα","","0.2729","0.0671","","","0.1157","0.1691","","","","","","1.013","","","","has coordinates","301848","2025-08-21","12:23:37","" "7020882","8.902","0.003","9.285","0.003","10.041","0.003","92.616","0.005","93.46","0.005","105.802","0.004","795.5","0.4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H44 Cl2 N4 O20 P4 Ru2 -","- C12 H44 Cl2 N4 O20 P4 Ru2 -","- C12 H44 Cl2 N4 O20 P4 Ru2 -","1","0.5","","Liu, Bin; Ding, Tuo; Hua, Wei-Jie; Liu, Xue-Mei; Hu, Huai-Ming; Li, Shu-Hua; Zheng, Li-Min","Diruthenium(iii,iii) diphosphonate with a spin ground state S = 2","Dalton Transactions","2013","42","10","3429","","10.1039/c2dt32306k","","","0.71073","MoKα","","0.056","0.0405","","","0.0925","0.099","","","","","","1.013","","","","has coordinates","179913","2020-10-21","18:00:00","" "7020883","12.132","0.002","16.893","0.003","16.69","0.003","90","","108.229","0.002","90","","3248.9","1","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H44 Cl N4 O20 P4 Ru2 -","- C12 H44 Cl N4 O20 P4 Ru2 -","- C48 H176 Cl4 N16 O80 P16 Ru8 -","4","1","","Liu, Bin; Ding, Tuo; Hua, Wei-Jie; Liu, Xue-Mei; Hu, Huai-Ming; Li, Shu-Hua; Zheng, Li-Min","Diruthenium(iii,iii) diphosphonate with a spin ground state S = 2","Dalton Transactions","2013","42","10","3429","","10.1039/c2dt32306k","","","0.71073","MoKα","","0.055","0.0381","","","0.097","0.1105","","","","","","1.036","","","","has coordinates","179913","2020-10-21","18:00:00","" "7020891","25.224","0.0014","15.1903","0.0004","20.1965","0.0011","90","","137.614","0.011","90","","5216.7","1.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C58 H42 B Cl6 Cu F4 N4 -","- C58 H42 B Cl6 Cu F4 N4 -","- C232 H168 B4 Cl24 Cu4 F16 N16 -","4","0.5","","Papanikolaou, Panagiotis; Mohanraj, John; Czapik, Agnieszka; Gdaniec, Maria; Accorsi, Gianluca; Akrivos, Pericles","Capturing the geometry of the emissive state of a Cu(i) red emitter through strong intramolecular stacking forces","Dalton Transactions","2013","42","10","3357","","10.1039/c2dt32324a","","","0.71073","MoKα","","0.0697","0.0612","","","0.1631","0.1709","","","","","","1.045","","","","has coordinates,has disorder","179913","2020-10-21","18:00:00","" "7020892","13.848","0.004","17.564","0.005","19.573","0.002","90","","90","","90","","4761","2","293","2","293","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C56 H40 Cu2 I2 N4 -","- C56 H40 Cu2 I2 N4 -","- C224 H160 Cu8 I8 N16 -","4","0.5","","Papanikolaou, Panagiotis; Mohanraj, John; Czapik, Agnieszka; Gdaniec, Maria; Accorsi, Gianluca; Akrivos, Pericles","Capturing the geometry of the emissive state of a Cu(i) red emitter through strong intramolecular stacking forces","Dalton Transactions","2013","42","10","3357","","10.1039/c2dt32324a","","","0.71073","MoKα","","0.0812","0.0628","","","0.1397","0.1531","","","","","","1.039","","","","has coordinates","179913","2020-10-21","18:00:00","" "7020902","14.1354","0.0015","16.2354","0.0016","18.261","0.0019","85.536","0.002","87.94","0.002","88.518","0.002","4174.3","0.7","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C9 H96 Ag As8 Mo12 N14 O74 -","- C7 Ag As8 Mo12 N7 O79 -","- C14 Ag2 As16 Mo24 N14 O158 -","2","1","","Ma, Ying; Xue, Qi; Min, Suotian; Zhang, Yanping; Hu, Huaiming; Gao, Shengli; Xue, Ganglin","An unusual fan-type polyanion with a silver cation located at the axial center, [AgAsIII2(AsIIIAsVMo4O18(OH)2)3]11−","Dalton Transactions","2013","42","10","3410","","10.1039/c2dt32401f","","","0.71073","MoKα","","0.0734","0.0562","","","0.1415","0.1513","","","","","","1.042","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020918","13.4231","0.0002","17.6047","0.0002","34.0211","0.0004","90","","99.6903","0.0006","90","","7924.81","0.18","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1'-(diphenylphosphino)ferrocenyl]methanol-borane (1/1)","","- C23 H24 B Fe O P -","- C23 H24 B Fe O P -","- C368 H384 B16 Fe16 O16 P16 -","16","4","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0885","0.0506","","","0.1209","0.1405","","","","","","1.041","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00","" "7020919","8.7423","0.0002","9.3366","0.0003","24.9336","0.0008","90","","90","","90","","2035.16","0.1","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[(Sp)-2-(diphenylphosphino)ferrocenyl]methanol‒borane (1/1)","","- C23 H24 B Fe O P -","- C23 H24 B Fe O P -","- C92 H96 B4 Fe4 O4 P4 -","4","1","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0429","0.0344","","","0.0692","0.0729","","","","","","1.047","","","","has coordinates","211332","2020-10-21","18:00:00","" "7020920","13.33","0.0008","17.5284","0.001","34.422","0.002","90","","100.118","0.002","90","","7917.7","0.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 B Fe P -","- C23 H24 B Fe P -","- C368 H384 B16 Fe16 P16 -","16","4","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0874","0.0422","","","0.0891","0.1042","","","","","","1.011","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020921","9.4573","0.0002","13.4113","0.0003","17.4666","0.0004","88.596","0.001","81.764","0.001","75.498","0.001","2122.52","0.08","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","1-(diphenylphosphino)-1'-(methoxymethyl)ferrocene-borane (1/1)","","- C24 H26 B Fe O P -","- C24 H26 B Fe O P -","- C96 H104 B4 Fe4 O4 P4 -","4","2","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.052","0.0416","","","0.1056","0.1091","","","","","","1.145","","","","has coordinates","211332","2020-10-21","18:00:00","" "7020922","10.896","0.0002","17.2531","0.0003","10.9826","0.0002","90","","106.343","0.0011","90","","1981.19","0.06","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(diphenylphosphino)-1'-(methoxymethyl)ferrocene","","- C24 H23 Fe O P -","- C24 H23 Fe O P -","- C96 H92 Fe4 O4 P4 -","4","1","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.035","0.028","","","0.07","0.0726","","","","","","1.051","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020923","9.7055","0.0008","10.2413","0.0011","30.665","0.002","90","","98.795","0.008","90","","3012.2","0.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H37 Cl2 Fe O P Ru -","- C34 H37 Cl2 Fe O P Ru -","- C136 H148 Cl8 Fe4 O4 P4 Ru4 -","4","1","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0857","0.0567","","","0.1012","0.1116","","","","","","1.157","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020924","10.575","0.0007","13.9675","0.0008","14.6","0.0008","96.764","0.004","97.044","0.005","111.478","0.006","1960.5","0.2","150","2","150","2","","","","","","","","10","P -1","-P 1","2","","","","- C36.5 H40.5 Cl2.5 F6 Fe N O P Ru Sb -","- C36.5 H40.5 Cl2.5 F6 Fe N O P Ru Sb -","- C73 H81 Cl5 F12 Fe2 N2 O2 P2 Ru2 Sb2 -","2","1","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0371","0.0274","","","0.062","0.0698","","","","","","1.13","","","","has coordinates","176453","2020-10-21","18:00:00","" "7020925","13.4772","0.0003","9.1167","0.0002","17.3793","0.0004","90","","98.485","0.001","90","","2111.98","0.08","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H46 Cl2 Fe2 O2 P2 Pd -","- C48 H46 Cl2.01 Fe2 O2 P2 Pd -","- C96 H92 Cl4.02 Fe4 O4 P4 Pd2 -","2","0.5","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0446","0.0309","","","0.0723","0.0772","","","","","","1.073","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020926","22.7193","0.0003","18.7832","0.0003","15.3334","0.0002","90","","131.434","0.0006","90","","4905.73","0.13","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C49 H48 Cl6 Fe2 O2 P2 Pd2 -","- C48 H46 Cl4 Fe2 O2 P2 Pd2 -","- C192 H184 Cl16 Fe8 O8 P8 Pd8 -","4","0.5","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0465","0.0427","","","0.1081","0.1107","","","","","","1.05","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020927","13.4348","0.0004","9.1071","0.0003","17.4178","0.0007","90","","98.86","0.001","90","","2105.67","0.13","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H46 Cl2 Fe2 O2 P2 Pt -","- C48 H46 Cl2 Fe2 O2 P2 Pt -","- C96 H92 Cl4 Fe4 O4 P4 Pt2 -","2","0.5","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0218","0.0168","","","0.0368","0.0382","","","","","","1.027","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020928","13.1234","0.0003","26.056","0.0006","13.6517","0.0003","90","","102.489","0.001","90","","4557.65","0.18","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C49 H48 Cu F3 Fe2 O6 P2 S -","- C49 H48 Cu F3 Fe2 O6 P2 S -","- C196 H192 Cu4 F12 Fe8 O24 P8 S4 -","4","1","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0658","0.0583","","","0.1527","0.1602","","","","","","1.04","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020929","6.4488","0.0003","7.7891","0.0004","39.978","0.002","90","","90","","90","","2008.11","0.17","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H31 Fe O P -","- C23 H31 Fe O P -","- C92 H124 Fe4 O4 P4 -","4","1","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.0788","0.0446","","","0.0905","0.1052","","","","","","1.005","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020930","6.3769","0.0001","7.9364","0.0002","39.9711","0.0008","90","","90","","90","","2022.92","0.07","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H30 Br Fe P -","- C22 H30 Br Fe P -","- C88 H120 Br4 Fe4 P4 -","4","1","","Štěpnička, Petr; Císařová, Ivana","Selective borane reduction of phosphinoferrocene carbaldehydes to phosphinoalcohol‒borane adducts. The coordination behaviour of 1-(diphenylphosphino)- 1′-(methoxymethyl)ferrocene, a new ferrocene O,P-hybrid donor prepared from such an adduct","Dalton Transactions","2013","42","10","3373","","10.1039/c2dt32511j","","","0.71073","MoKα","","0.053","0.044","","","0.1118","0.116","","","","","","1.116","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020931","21.7696","0.0013","21.7696","0.0013","8.7212","0.0007","90","","90","","120","","3579.4","0.4","122.3","0.2","122.3","0.2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","","","- C10 H9.6 Cu O5.8 -","- C10 H8 Cu O5 -","- C120 H96 Cu12 O60 -","12","1","","Shen, Bo; Shi, Peng-Fei; Hou, Yin-Ling; Wan, Fan-Fan; Gao, Dong-Liang; Zhao, Bin","Structural diversity and magnetic properties of five copper‒organic frameworks containing one-, two-, and three-types of organic ligands","Dalton Transactions","2013","42","10","3455","","10.1039/c2dt32515b","","","0.7107","MoKα","","0.0716","0.0488","","","0.0979","0.1057","","","","","","1.004","","","","has coordinates","176453","2020-10-21","18:00:00","" "7020932","22.116","0.002","11.5791","0.0006","16.8051","0.0018","90","","130.986","0.016","90","","3248.6","0.9","122.3","0.2","122.3","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16.5 H15.5 Cu N1.5 O5.5 -","- C16.5 H12 Cu N1.5 O5.5 -","- C132 H96 Cu8 N12 O44 -","8","1","","Shen, Bo; Shi, Peng-Fei; Hou, Yin-Ling; Wan, Fan-Fan; Gao, Dong-Liang; Zhao, Bin","Structural diversity and magnetic properties of five copper‒organic frameworks containing one-, two-, and three-types of organic ligands","Dalton Transactions","2013","42","10","3455","","10.1039/c2dt32515b","","","0.7107","MoKα","","0.082","0.0594","","","0.1446","0.1609","","","","","","1.048","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00","" "7020933","23.934","0.007","29.782","0.005","10.9902","0.0018","90","","90","","90","","7834","3","293","2","293","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C20 H19 Cu N2 O6.5 -","- C20 H18 Cu N2 O6.5 -","- C320 H288 Cu16 N32 O104 -","16","1","","Shen, Bo; Shi, Peng-Fei; Hou, Yin-Ling; Wan, Fan-Fan; Gao, Dong-Liang; Zhao, Bin","Structural diversity and magnetic properties of five copper‒organic frameworks containing one-, two-, and three-types of organic ligands","Dalton Transactions","2013","42","10","3455","","10.1039/c2dt32515b","","","0.7107","MoKα","","0.1433","0.0754","","","0.1457","0.1785","","","","","","1.009","","","","has coordinates","176453","2020-10-21","18:00:00","" "7020934","29.8354","0.0013","11.8641","0.0005","11.1225","0.0004","90","","90","","90","","3937","0.3","122.3","0.2","122.3","0.2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C40 H37 Cl Cu2 N4 O13 -","- C40 H37 Cl Cu2 N4 O13 -","- C160 H148 Cl4 Cu8 N16 O52 -","4","1","","Shen, Bo; Shi, Peng-Fei; Hou, Yin-Ling; Wan, Fan-Fan; Gao, Dong-Liang; Zhao, Bin","Structural diversity and magnetic properties of five copper‒organic frameworks containing one-, two-, and three-types of organic ligands","Dalton Transactions","2013","42","10","3455","","10.1039/c2dt32515b","","","0.7107","MoKα","","0.1011","0.0791","","","0.1797","0.1975","","","","","","1.035","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020935","11.2073","0.0006","28.6467","0.0017","21.996","0.0014","90","","117.764","0.004","90","","6248.9","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H58 Cl2 Cu3 N8 O20 -","- C60 H57 Cl2 Cu3 N8 O20 -","- C240 H228 Cl8 Cu12 N32 O80 -","4","1","","Shen, Bo; Shi, Peng-Fei; Hou, Yin-Ling; Wan, Fan-Fan; Gao, Dong-Liang; Zhao, Bin","Structural diversity and magnetic properties of five copper‒organic frameworks containing one-, two-, and three-types of organic ligands","Dalton Transactions","2013","42","10","3455","","10.1039/c2dt32515b","","","0.71073","MOKα","","0.1945","0.0763","","","0.1461","0.1708","","","","","","0.817","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020944","40.03","0.003","12.6014","0.0018","21.3785","0.0015","90","","92.539","0.003","90","","10773.5","1.9","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C94 H86 N20 O19 Pd4 -","- C94 H86 N20 O19 Pd4 -","- C376 H344 N80 O76 Pd16 -","4","0.5","","Yao, Liao-Yuan; Yu, Zheng-Su; Qin, Lin; Li, Yi-Zhi; Qin, Yu; Yu, Shu-Yan","Self-assembly of metallomacrocycles with dipyrazole ligands and anion sensing of [Pd4Fe2] macrocycle with ferrocene-based dipyrazole ligand","Dalton Transactions","2013","42","10","3447","","10.1039/c2dt32576d","","","0.71073","MoKα","","0.0887","0.0651","","","0.1322","0.1372","","","","","","1.094","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020945","26.922","0.012","26.922","0.012","15.467","0.005","90","","90","","90","","11210","8","293","2","293","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C84 H80 Fe2 N20 O12 Pd4 -","- C84 H80 Fe2 N20 O12 Pd4 -","- C336 H320 Fe8 N80 O48 Pd16 -","4","0.25","","Yao, Liao-Yuan; Yu, Zheng-Su; Qin, Lin; Li, Yi-Zhi; Qin, Yu; Yu, Shu-Yan","Self-assembly of metallomacrocycles with dipyrazole ligands and anion sensing of [Pd4Fe2] macrocycle with ferrocene-based dipyrazole ligand","Dalton Transactions","2013","42","10","3447","","10.1039/c2dt32576d","","","0.71073","MoKα","","0.0737","0.0413","","","0.0766","0.0833","","","","","","1.008","","","","has coordinates","176432","2020-10-21","18:00:00","" "7020958","10.6462","0.0005","15.7072","0.0007","19.9882","0.0009","90","","95.374","0.001","90","","3327.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H29 F12 N O2 W -","- C34 H29 F12 N O2 W -","- C136 H116 F48 N4 O8 W4 -","4","1","","O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Unusually stable tungstenacyclobutadienes featuring an ONO trianionic pincer-type ligand","Dalton Transactions","2013","42","10","3326","","10.1039/c2dt32653a","","","0.71073","MoKα","","0.0178","0.0145","","","0.0369","0.0376","","","","","","1.052","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020959","19.6072","0.0011","9.2537","0.0005","18.9077","0.001","90","","112.563","0.001","90","","3168","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H33 F12 N O2 W -","- C33 H33 F12 N O2 W -","- C132 H132 F48 N4 O8 W4 -","4","1","","O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Unusually stable tungstenacyclobutadienes featuring an ONO trianionic pincer-type ligand","Dalton Transactions","2013","42","10","3326","","10.1039/c2dt32653a","","","0.71073","MoKα","","0.0297","0.0209","","","0.0448","0.0462","","","","","","0.962","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020960","17.6465","0.0014","9.8689","0.0008","19.5331","0.0016","90","","104.391","0.001","90","","3295","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H33 F12 N O2 W -","- C32 H33 F12 N O2 W -","- C128 H132 F48 N4 O8 W4 -","4","1","","O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Unusually stable tungstenacyclobutadienes featuring an ONO trianionic pincer-type ligand","Dalton Transactions","2013","42","10","3326","","10.1039/c2dt32653a","","","0.71073","MoKα","","0.0276","0.022","","","0.0482","0.0496","","","","","","1.089","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020961","11.4139","0.0018","9.5278","0.0015","28.609","0.005","90","","97.389","0.003","90","","3085.4","0.9","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H31 F12 N O3 W -","- C29 H31 F12 N O3 W -","- C116 H124 F48 N4 O12 W4 -","4","1","","O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Unusually stable tungstenacyclobutadienes featuring an ONO trianionic pincer-type ligand","Dalton Transactions","2013","42","10","3326","","10.1039/c2dt32653a","","","0.71073","MoKα","","0.035","0.0242","","","0.0473","0.0496","","","","","","1.056","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020964","11.0192","0.001","17.8227","0.0015","16.3592","0.0015","90","","106.482","0.003","90","","3080.8","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H31 B F10 N P -","- C34 H31 B F10 N P -","- C136 H124 B4 F40 N4 P4 -","4","1","","Jiang, Chunfang; Stephan, Douglas W.","Hydrophosphination of vinyl-boranes with phosphinoamines","Dalton Transactions","2013","42","10","3318","","10.1039/c2dt32677a","","","0.71073","MoKα","","0.0455","0.0346","","","0.083","0.0891","","","","","","1.023","","","","has coordinates","301848","2025-08-21","12:23:37","" "7020965","9.8983","0.0015","10.3188","0.0014","15.235","0.002","88.992","0.004","87.851","0.005","63.756","0.004","1394.7","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H29 B F10 N P -","- C29 H29 B F10 N P -","- C58 H58 B2 F20 N2 P2 -","2","1","","Jiang, Chunfang; Stephan, Douglas W.","Hydrophosphination of vinyl-boranes with phosphinoamines","Dalton Transactions","2013","42","10","3318","","10.1039/c2dt32677a","","","0.71073","MoKα","","0.049","0.0401","","","0.1176","0.1265","","","","","","1.063","","","","has coordinates","301848","2025-08-21","12:23:38","" "7020966","8.9145","0.0004","19.2534","0.0011","17.0916","0.0009","90","","99.678","0.002","90","","2891.8","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H33 B F10 N P -","- C31 H33 B F10 N P -","- C124 H132 B4 F40 N4 P4 -","4","1","","Jiang, Chunfang; Stephan, Douglas W.","Hydrophosphination of vinyl-boranes with phosphinoamines","Dalton Transactions","2013","42","10","3318","","10.1039/c2dt32677a","","","0.71073","MoKα","","0.0561","0.038","","","0.0883","0.0974","","","","","","1.017","","","","has coordinates","301848","2025-08-21","12:23:38","" "7020967","19.5503","0.0016","11.7262","0.0008","33.928","0.003","90","","97.717","0.003","90","","7707.6","1.1","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C45 H39 B F10 N P -","- C45 H39 B F10 N P -","- C360 H312 B8 F80 N8 P8 -","8","1","","Jiang, Chunfang; Stephan, Douglas W.","Hydrophosphination of vinyl-boranes with phosphinoamines","Dalton Transactions","2013","42","10","3318","","10.1039/c2dt32677a","","","0.71073","MoKα","","0.1132","0.0536","","","0.1084","0.1345","","","","","","0.941","","","","has coordinates","301848","2025-08-21","12:23:38","" "7020971","11.183","0.0005","30.264","0.0012","12.575","0.0005","90","","95.151","0.001","90","","4238.7","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H68 N8 Na2 P2 Te2 -","- C28 H65 N8 Na2 P2 Te2 -","- C112 H260 N32 Na8 P8 Te8 -","4","1","","Nordheider, Andreas; Chivers, Tristram; Thirumoorthi, Ramalingam; Athukorala Arachchige, Kasun S.; Slawin, Alexandra M. Z.; Woollins, J. Derek; Vargas-Baca, Ignacio","A planar dianionic ditelluride and a cyclic tritelluride supported by P2N2 rings","Dalton Transactions","2013","42","10","3291","","10.1039/c2dt32716c","","","0.71073","MoKα","","0.0835","0.065","","","0.1505","0.1787","","","","","","1.194","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "7020972","13.76","0.003","14.301","0.003","14.481","0.003","60.533","0.005","69.151","0.005","65.043","0.005","2209.2","0.8","93","","93","","","","","","","","","6","P -1","-P 1","2","","","","- C72 H136 Li2 N12 P4 Te4 -","- C76 H136 Li2 N12 P4 Te4 -","- C76 H136 Li2 N12 P4 Te4 -","1","0.5","","Nordheider, Andreas; Chivers, Tristram; Thirumoorthi, Ramalingam; Athukorala Arachchige, Kasun S.; Slawin, Alexandra M. Z.; Woollins, J. Derek; Vargas-Baca, Ignacio","A planar dianionic ditelluride and a cyclic tritelluride supported by P2N2 rings","Dalton Transactions","2013","42","10","3291","","10.1039/c2dt32716c","","","0.71075","MoKα","","","0.0419","","","","0.1163","","","","","","1.036","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020973","33.149","0.0002","14.263","0.0003","11.542","0.0003","90","0.0009","107.354","0.0011","90","0.0012","5208.7","0.18","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H36 N4 P2 Te3 -","- C16 H36 N4 P2 Te3 -","- C128 H288 N32 P16 Te24 -","8","1","","Nordheider, Andreas; Chivers, Tristram; Thirumoorthi, Ramalingam; Athukorala Arachchige, Kasun S.; Slawin, Alexandra M. Z.; Woollins, J. Derek; Vargas-Baca, Ignacio","A planar dianionic ditelluride and a cyclic tritelluride supported by P2N2 rings","Dalton Transactions","2013","42","10","3291","","10.1039/c2dt32716c","","","0.71073","MoKα","","0.0416","0.0358","","","0.0715","0.0742","","","","","","1.149","","","","has coordinates","301848","2025-08-21","12:23:38","" "7020974","13.232","0.004","14.228","0.004","24.627","0.008","90","","104.587","0.012","90","","4487","2","93","","93","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H74 N8 P4 Te2 -","- C32 H74 N8 P4 Te2 -","- C128 H296 N32 P16 Te8 -","4","0.5","","Nordheider, Andreas; Chivers, Tristram; Thirumoorthi, Ramalingam; Athukorala Arachchige, Kasun S.; Slawin, Alexandra M. Z.; Woollins, J. Derek; Vargas-Baca, Ignacio","A planar dianionic ditelluride and a cyclic tritelluride supported by P2N2 rings","Dalton Transactions","2013","42","10","3291","","10.1039/c2dt32716c","","","0.71075","MoKα","","","0.0554","","","","0.1179","","","","","","1.066","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020975","21.71","0.004","21.271","0.004","22.414","0.005","90","","106.51","0.03","90","","9924","4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H86 N8 Na4 P4 -","- C32 H58.5 N8 Na4 P4 -","- C256 H468 N64 Na32 P32 -","8","2","","Nordheider, Andreas; Chivers, Tristram; Thirumoorthi, Ramalingam; Athukorala Arachchige, Kasun S.; Slawin, Alexandra M. Z.; Woollins, J. Derek; Vargas-Baca, Ignacio","A planar dianionic ditelluride and a cyclic tritelluride supported by P2N2 rings","Dalton Transactions","2013","42","10","3291","","10.1039/c2dt32716c","","","0.71073","MoKα","","0.133","0.0991","","","0.2652","0.2919","","","","","","1.036","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44","" "7020979","20.712","0.003","9.4816","0.0013","8.0453","0.0012","90","","90","","90","","1580","0.4","93","","93","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C25 H13 N -","- C25 H13 N -","- C100 H52 N4 -","4","1","","Yamada, Mihoko; Tashiro, Shohei; Miyake, Ryosuke; Shionoya, Mitsuhiko","A cyclopalladated complex of corannulene with a pyridine pendant and its columnar self-assembly","Dalton Transactions","2013","42","10","3300","","10.1039/c2dt32883f","","","0.71075","MoKα","","","0.0862","","","","0.2365","","","","","","1.134","","","","has coordinates","179914","2020-10-21","18:00:00","" "7020980","20.102","0.003","7.2793","0.0009","64.688","0.008","90","","90","","90","","9466","2","93","","93","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C29 H18 B F4 N3 Pd -","- C29 H18 B F4 N3 Pd -","- C464 H288 B16 F64 N48 Pd16 -","16","2","","Yamada, Mihoko; Tashiro, Shohei; Miyake, Ryosuke; Shionoya, Mitsuhiko","A cyclopalladated complex of corannulene with a pyridine pendant and its columnar self-assembly","Dalton Transactions","2013","42","10","3300","","10.1039/c2dt32883f","","","0.71073","MoKα","","0.1475","0.1025","","","0.1702","0.1846","","","","","","1.228","","","","has coordinates,has disorder","179914","2020-10-21","18:00:00","" "7020986","28.355","0.0002","28.355","0.0002","33.188","0.0005","90","","90","","90","","26683.4","0.5","293","2","293","2","","","","","","","","5","P 4/n n c :2","-P 4a 2bc","126","","","","- C408 H700 Cd30 N60 O194 -","- C408 H504 Cd30 N48 O126 -","- C816 H1008 Cd60 N96 O252 -","2","0.125","","Gong, Wei-Jie; Liu, Ying-Ying; Yang, Jin; Wu, Hua; Ma, Jian-Fang; Xie, Teng-Feng","An unprecedented octahedral {Cd30} nanocage supported by twelve pendant-armed tetraacetate macrocyclic ligands","Dalton Transactions","2013","42","10","3304","","10.1039/c3dt32801e","","","1.54184","CuKα","","0.1395","0.1157","","","0.2394","0.248","","","","","","1.198","","","","has coordinates","179914","2020-10-21","18:00:00",""