# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-01T14:33:25+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 'European journal of medicinal 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
"1549446","17.898","0.004","22.4914","0.0019","23.4","0.005","90","","90","","90","","9420","3","120","2","120","2","","","","","","","","6","P b n a","-P 2ac 2b","60","","","","- C92 H80 Au4 N16 O13 P4 -","- C92 H80 Au4 N16 O13 P4 -","- C368 H320 Au16 N64 O52 P16 -","4","0.5","","Illán-Cabeza, Nuria A; García-García, Antonio R; Martínez-Martos, José M; Ramírez-Expósito, María J; Peña-Ruiz, Tomás; Moreno-Carretero, Miguel N","A potential antitumor agent, (6-amino-1-methyl-5-nitrosouracilato-N3)-triphenylphosphine-gold(I): structural studies and in vivo biological effects against experimental glioma.","European journal of medicinal chemistry","2013","64","","260","272","10.1016/j.ejmech.2013.03.067","","","0.71073","MoKα","","0.0846","0.0495","","","0.0735","0.0817","","","","","","1.079","","","","has coordinates","207914","2020-10-21","18:00:00",""
"1560193","15.0063","0.0009","14.1711","0.0008","17.7959","0.0011","90","","91.705","0.001","90","","3782.7","0.4","173","1","173","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H41 N3 O6 Zn -","- C44 H41 N3 O6 Zn -","- C176 H164 N12 O24 Zn4 -","4","2","","Hijazi Abu Ali; Hadeel Fares; Mohanad Darawsheh; Emilia Rappocciolo; Mutaz Akkawi; Suhair Jaber","Synthesis, characterization and biological activity of new mixed ligand complexes of Zn(II) naproxen with nitrogen based ligands","European Journal of Medicinal Chemistry","2015","89","","67","76","10.1016/j.ejmech.2014.10.032","","","0.71073","MoKα","","0.0978","0.0698","","","0.1714","0.1878","","","","","","0.993","","","","has coordinates","261185","2021-01-25","09:30:53",""
"3000018","14.9135","0.0008","8.5203","0.0005","17.769","0.001","90","","111.617","0.001","90","","2099.1","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 Cl2 Mn N16 O14 -","- C28 H44 Cl2 Mn N16 O14 -","- C56 H88 Cl4 Mn2 N32 O28 -","2","0.5","","Ana B. Caballero; Antonio Rodríguez Diéguez; Miguel Quirós; Juan M. Salas; Óscar Huertas; Inmaculada Ramírez Macías; Francisco Olmo; Clotilde Marín; Guillermo Chaves-Lemaur; Ramón Gutiérrez Sánchez; Manuel Sánchez-Moreno","Triazolopyrimidine Compounds Containing First-Row Transition Metals and their Activity against the Neglected Infectious Chagas Disease and Leishmaniasis","European Journal of Medicinal Chemistry","2014","85","","526","534","10.1016/j.ejmech.2014.08.26","","","0.71073","MoKα","","0.0415","0.0374","","","0.1067","0.1097","","","","","","1.076","","","","has coordinates,has Fobs","250894","2020-10-21","18:00:00",""
"3000019","14.8776","0.0011","8.5567","0.0006","17.669","0.0013","90","","111.748","0.001","90","","2089.2","0.3","570","2","570","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 Cl2 Fe N16 O14 -","- C28 H44 Cl2 Fe N16 O14 -","- C56 H88 Cl4 Fe2 N32 O28 -","2","0.5","","Ana B. Caballero; Antonio Rodríguez Diéguez; Miguel Quirós; Juan M. Salas; Óscar Huertas; Inmaculada Ramírez Macías; Francisco Olmo; Clotilde Marín; Guillermo Chaves-Lemaur; Ramón Gutiérrez Sánchez; Manuel Sánchez-Moreno","Triazolopyrimidine Compounds Containing First-Row Transition Metals and their Activity against the Neglected Infectious Chagas Disease and Leishmaniasis","European Journal of Medicinal Chemistry","2014","85","","526","534","10.1016/j.ejmech.2014.08.26","","","0.71073","MoKα","","0.0417","0.037","","","0.1054","0.109","","","","","","1.092","","","","has coordinates,has Fobs","250894","2020-10-21","18:00:00",""
"3000020","14.8283","0.0008","8.5796","0.0005","17.6281","0.001","90","","111.957","0.001","90","","2080","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 Cl2 Co N16 O14 -","- C28 H44 Cl2 Co N16 O14 -","- C56 H88 Cl4 Co2 N32 O28 -","2","0.5","","Ana B. Caballero; Antonio Rodríguez Diéguez; Miguel Quirós; Juan M. Salas; Óscar Huertas; Inmaculada Ramírez Macías; Francisco Olmo; Clotilde Marín; Guillermo Chaves-Lemaur; Ramón Gutiérrez Sánchez; Manuel Sánchez-Moreno","Triazolopyrimidine Compounds Containing First-Row Transition Metals and their Activity against the Neglected Infectious Chagas Disease and Leishmaniasis","European Journal of Medicinal Chemistry","2014","85","","526","534","10.1016/j.ejmech.2014.08.26","","","0.71073","MoKα","","0.0393","0.0355","","","0.1021","0.105","","","","","","1.067","","","","has coordinates,has Fobs","250894","2020-10-21","18:00:00",""
"3000021","14.8078","0.0008","8.6073","0.0005","17.5587","0.001","90","","112.121","0.001","90","","2073.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 Cl2 N16 Ni O14 -","- C28 H44 Cl2 N16 Ni O14 -","- C56 H88 Cl4 N32 Ni2 O28 -","2","0.5","","Ana B. Caballero; Antonio Rodríguez Diéguez; Miguel Quirós; Juan M. Salas; Óscar Huertas; Inmaculada Ramírez Macías; Francisco Olmo; Clotilde Marín; Guillermo Chaves-Lemaur; Ramón Gutiérrez Sánchez; Manuel Sánchez-Moreno","Triazolopyrimidine Compounds Containing First-Row Transition Metals and their Activity against the Neglected Infectious Chagas Disease and Leishmaniasis","European Journal of Medicinal Chemistry","2014","85","","526","534","10.1016/j.ejmech.2014.08.26","","","0.71073","MoKα","","0.0387","0.0354","","","0.1027","0.1056","","","","","","1.029","","","","has coordinates,has Fobs","250894","2020-10-21","18:00:00",""
"3000022","8.6399","0.0009","11.9756","0.0012","19.1916","0.0018","90","","90.352","0.001","90","","1985.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 Cl2 Cu N16 O12 -","- C28 H40 Cl2 Cu N16 O12 -","- C56 H80 Cl4 Cu2 N32 O24 -","2","0.5","","Ana B. Caballero; Antonio Rodríguez Diéguez; Miguel Quirós; Juan M. Salas; Óscar Huertas; Inmaculada Ramírez Macías; Francisco Olmo; Clotilde Marín; Guillermo Chaves-Lemaur; Ramón Gutiérrez Sánchez; Manuel Sánchez-Moreno","Triazolopyrimidine Compounds Containing First-Row Transition Metals and their Activity against the Neglected Infectious Chagas Disease and Leishmaniasis","European Journal of Medicinal Chemistry","2014","85","","526","534","10.1016/j.ejmech.2014.08.26","","","0.71073","MoKα","","0.0773","0.0514","","","0.1257","0.1403","","","","","","0.999","","","","has coordinates,has Fobs","250894","2020-10-21","18:00:00",""
"3000023","14.83","0.002","8.5741","0.0012","17.618","0.002","90","","111.98","0.002","90","","2077.4","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 Cl2 N16 O14 Zn -","- C28 H44 Cl2 N16 O14 Zn -","- C56 H88 Cl4 N32 O28 Zn2 -","2","0.5","","Ana B. Caballero; Antonio Rodríguez Diéguez; Miguel Quirós; Juan M. Salas; Óscar Huertas; Inmaculada Ramírez Macías; Francisco Olmo; Clotilde Marín; Guillermo Chaves-Lemaur; Ramón Gutiérrez Sánchez; Manuel Sánchez-Moreno","Triazolopyrimidine Compounds Containing First-Row Transition Metals and their Activity against the Neglected Infectious Chagas Disease and Leishmaniasis","European Journal of Medicinal Chemistry","2014","85","","526","534","10.1016/j.ejmech.2014.08.26","","","0.71073","MoKα","","0.0746","0.0519","","","0.1398","0.1685","","","","","","1.029","","","","has coordinates,has Fobs","250894","2020-10-21","18:00:00",""