# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-07T18:37:39+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 'Transition Metal Chemistry') 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
"1523034","10.114","","7.662","","3.897","","105","","81.8","","96.4","","287.84","","","","","","","","","","","","","5","P -1","-P 1","2","","Fe (S C (N H2)2)2 (N C S)2","","- C4 H8 Fe N6 S4 -","- C4 H8 Fe N6 S4 -","- C4 H8 Fe N6 S4 -","1","0.5","","Valle, G.; Russo, U.; Calogero, S.","The crystal and molecular structure of bis(thiourea)iron(II) thiocyanate","Transition Metal Chemistry","1980","5","","26","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534371","9.293","","10.122","","16.737","","90","","103.44","","90","","1531.23","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Co (C2 H6 N5)3 (H2 O)2","","- C6 H22 Co N15 O2 -","- C6 H22 Co N15 O2 -","- C24 H88 Co4 N60 O8 -","4","1","","Coghi, L.; Lanfranchi, M.; Pelizzi, G.; Tarasconi, P.","Structural researches on the chelating behaviour of the biguanide ligand. The crystal structure of Co (C2 H6 N5)3 (H2 O)2 and Cu (C2 H7 N5)2 C O3 (H2 O)4","Transition Metal Chemistry","1978","3","","69","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:10",""
"1534372","13.185","","17.546","","6.871","","90","","107.01","","90","","1520.03","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Cu (C2 H7 N5)2 C O3 (H2 O)4","","- C5 H14 Cu N10 O7 -","- C5 H14 Cu N10 O7 -","- C20 H56 Cu4 N40 O28 -","4","1","","Coghi, L.; Lanfranchi, M.; Pelizzi, G.; Tarasconi, P.","Structural researches on the chelating behaviour of the biguanide ligand. The crystal structures of Co (C2 H6 N5)3 (H2 O)2 and Cu (C2 H7 N5)2 C O3 (H2 O)4","Transition Metal Chemistry","1978","3","","69","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535551","9.3599","","9.879","","16.014","","90","","90","","90","","1480.76","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(Os2 (C O)8 Cl2)","","- C8 Cl2 O8 Os2 -","- C8 Cl2 O8 Os2 -","- C32 Cl8 O32 Os8 -","4","1","","Moss, J.R.; Niven, M.L.; Sutton, E.E.","Di- and tri-nuclear osmium carbonyl chloride complexes: x-ray structures of Os2 (C O)8 Cl2 and Os3 (C O)12 Cl2","Transition Metal Chemistry","1988","13","","429","433","","","","","","","","","","","","","","","","","","","","","","has coordinates","162959","2020-10-21","18:00:00",""
"1535555","12.105","","10.612","","8.798","","90","","117.02","","90","","1006.82","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","(Os3 (C O)12 Cl2)","","- C12 Cl2 O12 Os3 -","- C12 Cl2 O12 Os3 -","- C24 Cl4 O24 Os6 -","2","0.25","","Moss, J.R.; Niven, M.L.; Sutton, E.E.","Di- and tri-nuclear osmium carbonyl chloride complexes: x-ray structures of Os2 (C O)8 Cl2 and Os3 (C O)12 Cl2","Transition Metal Chemistry","1988","13","","429","433","","","","","","","","","","","","","","","","","","","","","","has coordinates","162963","2020-10-21","18:00:00",""
"1541586","8.578","","10.446","","11.276","","68.92","","87.34","","67.01","","862.676","","","","","","","","","","","","","6","P -1","-P 1","2","","Na2 (N H4)4 ((V V8 Mo) O28) (H2 O)10","","- H36 Mo N4 Na2 O38 V9 -","- H36 Mo1.02 N4 Na2 O38 V8.98 -","- H36 Mo1.02 N4 Na2 O38 V8.98 -","1","0.5","","Hu, C.; Duan, C.; Reng, X.; Lu, C.; Liu, Y.; Meng, Q.; Chen, Y.; Cao, M.","Synthesis, structure and the e.s.r. spectrum of the mixed-valence molybdovanadate Na2 (N H4)4 ((V(IV) V(V)8 Mo) O28) (H2 O)10","Transition Metal Chemistry","2000","25","","141","144","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1562683","8.8717","0.0008","18.8801","0.0001","9.9362","0.0005","90","","100.916","0.001","90","","1634.19","0.17","150","","150","","","","","","","","","5","I 1 2/m 1","-I 2y","12","","","","- C30 H38 Cu2 N4 O19 -","- C30 H38 Cu2 N4 O19 -","- C60 H76 Cu4 N8 O38 -","2","0.25","","Nour Dissem; Prabhjyot Kaur; Love Karan Rana; Thierry Maris; Adam Duong","Synthesis, characterization and Hirshfeld surface analysis of a mixed-ligand copper (II) coordination polymer from 1,4,8,11-tetraazacyclotetradecane and pyromellitic dianhydride","Transition Metal Chemistry","2021","46","","283","290","10.1007/s11243-020-00444-2","","x-ray","1.34139","GaKα","","0.0443","0.0441","","","0.1168","0.1171","","","","","","1.097","","","","has coordinates,has disorder,has Fobs","265329","2021-05-19","13:09:34",""