# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-20T20:16:23+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 'Chemistry Central journal') 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
"1516835","11.6469","0.0004","12.2824","0.0004","14.1122","0.0004","82.427","0.002","72.489","0.002","84.915","0.002","1905.87","0.11","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C76 H48 Cl4 N8 O12 Pb4 S4 -","- C76 H48 Cl4 N8 O12 Pb4 S4 -","- C76 H48 Cl4 N8 O12 Pb4 S4 -","1","0.5","","Jennifer, Samson; Thomas Muthiah, Packianathan","Syntheses and characterization of two novel tetranuclear lead(II) clusters self-assembled by hydrogen bonded interactions","Chemistry Central Journal","2014","8","1","39","","10.1186/1752-153X-8-39","","","0.71073","MoKα","","0.0804","0.0381","","","0.0878","0.1054","","","","","","1.013","","","","has coordinates","301776","2025-08-18","14:47:50",""
"1516836","11.5185","0.0002","12.225","0.0002","14.7743","0.0002","81.913","0.001","72.349","0.001","84.455","0.001","1959.55","0.05","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C80 H48 Cl4 N8 O12 Pb4 S4 -","- C80 H48 Cl4 N8 O12 Pb4 S4 -","- C80 H48 Cl4 N8 O12 Pb4 S4 -","1","0.5","","Jennifer, Samson; Thomas Muthiah, Packianathan","Syntheses and characterization of two novel tetranuclear lead(II) clusters self-assembled by hydrogen bonded interactions","Chemistry Central Journal","2014","8","1","39","","10.1186/1752-153X-8-39","","","0.71073","MoKα","","0.0299","0.0232","","","0.0586","0.0618","","","","","","1.179","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1517291","8.6712","0.0003","10.3617","0.0004","12.286","0.0004","95.336","0.002","96.851","0.002","107.63","0.002","1034.75","0.07","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H14 Cl Cu N3 O9 S -","- C17 H14 Cl Cu N3 O9 S -","- C34 H28 Cl2 Cu2 N6 O18 S2 -","2","1","","Jennifer, Samson Jegan; Muthiah, Packianathan Thomas","Synthesis, crystal structures and supramolecular architectures of square pyramidal Cu(II) complexes containing aromatic chelating N,N'-donor ligands","Chemistry Central Journal","2014","8","1","42","","10.1186/1752-153X-8-42","","","0.71073","MoKα","","0.0427","0.0331","","","0.0837","0.0885","","","","","","1.04","","","","has coordinates","301776","2025-08-18","14:47:51",""
"1517292","23.8658","0.0004","16.6525","0.0004","11.3381","0.0002","90","","99.994","0.001","90","","4437.67","0.15","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H14 Cl2 Cu N2 O5 S2 -","- C20 H14 Cl2 Cu N2 O5 S2 -","- C160 H112 Cl16 Cu8 N16 O40 S16 -","8","1","","Jennifer, Samson Jegan; Muthiah, Packianathan Thomas","Synthesis, crystal structures and supramolecular architectures of square pyramidal Cu(II) complexes containing aromatic chelating N,N'-donor ligands","Chemistry Central Journal","2014","8","1","42","","10.1186/1752-153X-8-42","","","0.71073","MoKα","","0.0567","0.0335","","","0.0807","0.0919","","","","","","1.003","","","","has coordinates","301776","2025-08-18","14:47:51",""
"1517293","14.9443","0.0002","15.1728","0.0002","15.3055","0.0002","111.948","0.001","116.673","0.001","97.606","0.001","2681.16","0.08","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H18 Cl2 Cu N4 O6 S -","- C25 H18 Cl2 Cu N4 O6 S -","- C100 H72 Cl8 Cu4 N16 O24 S4 -","4","2","","Jennifer, Samson Jegan; Muthiah, Packianathan Thomas","Synthesis, crystal structures and supramolecular architectures of square pyramidal Cu(II) complexes containing aromatic chelating N,N'-donor ligands","Chemistry Central Journal","2014","8","1","42","","10.1186/1752-153X-8-42","","","0.71073","MoKα","","0.0885","0.0644","","","0.1942","0.2156","","","","","","1.045","","","","has coordinates","301776","2025-08-18","14:47:51",""
"1517294","13.4364","0.0003","10.4855","0.0003","20.039","0.0004","90","","123.741","0.001","90","","2347.69","0.1","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 Cl2 Cu N2 O5 S2 -","- C22 H14 Cl2 Cu N2 O5 S2 -","- C88 H56 Cl8 Cu4 N8 O20 S8 -","4","1","","Jennifer, Samson Jegan; Muthiah, Packianathan Thomas","Synthesis, crystal structures and supramolecular architectures of square pyramidal Cu(II) complexes containing aromatic chelating N,N'-donor ligands","Chemistry Central Journal","2014","8","1","42","","10.1186/1752-153X-8-42","","","0.71073","MoKα","","0.061","0.0375","","","0.093","0.106","","","","","","1.02","","","","has coordinates","301776","2025-08-18","14:47:51",""
"1517295","19.1486","0.0009","8.1694","0.0003","19.1208","0.0008","90","","102.385","0.004","90","","2921.5","0.2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 Cu2 N4 O16 P4 -","- C20 H24 Cu2 N4 O16 P4 -","- C80 H96 Cu8 N16 O64 P16 -","4","0.5","","Jennifer, Samson Jegan; Muthiah, Packianathan Thomas","Synthesis, crystal structures and supramolecular architectures of square pyramidal Cu(II) complexes containing aromatic chelating N,N'-donor ligands","Chemistry Central Journal","2014","8","1","42","","10.1186/1752-153X-8-42","","","0.71073","MoKα","","0.0532","0.0339","","","0.0869","0.109","","","","","","1.119","","","","has coordinates","301776","2025-08-18","14:47:51",""
"1518513","8.61","0.004","12.78","0.005","20.458","0.008","90","","101.72","0.03","90","","2204.2","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","TriboIV","","","- C28 H22 N2 O2 -","- C28 H22 N2 O2 -","- C112 H88 N8 O8 -","4","1","","Asiri, Abdullah M.; Heller, Harry G.; Hughes, David S.; Hursthouse, Michael B.; Kendrick, John; Leusen, Frank Jj; Montis, Riccardo","A mechanophysical phase transition provides a dramatic example of colour polymorphism: the tribochromism of a substituted tri(methylene)tetrahydrofuran-2-one.","Chemistry Central journal","2014","8","1","70","","10.1186/s13065-014-0070-3","","","0.71069","MoKα","","0.0891","0.0429","","","0.0835","0.0913","","","","","","0.809","","","","has coordinates","301776","2025-08-18","14:47:53",""
"1518514","14.384","0.0001","8.214","0.0005","17.365","0.0009","90","","105.53","0.003","90","","1976.77","0.16","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","TriboII","","","- C25 H18 N2 O2 -","- C25 H18 N2 O2 -","- C100 H72 N8 O8 -","4","1","","Asiri, Abdullah M.; Heller, Harry G.; Hughes, David S.; Hursthouse, Michael B.; Kendrick, John; Leusen, Frank Jj; Montis, Riccardo","A mechanophysical phase transition provides a dramatic example of colour polymorphism: the tribochromism of a substituted tri(methylene)tetrahydrofuran-2-one.","Chemistry Central journal","2014","8","1","70","","10.1186/s13065-014-0070-3","","","0.71069","MoKα","","0.0804","0.041","","","0.1138","0.1482","","","","","","0.491","","","","has coordinates","301776","2025-08-18","14:47:53",""
"1518515","10.07","0.03","23.91","0.05","9.5","0.05","90","","110.38","0.18","90","","2144","14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","TriboIIIa","","","- C27 H20 N2 O2 -","- C27 H20 N2 O2 -","- C108 H80 N8 O8 -","4","1","","Asiri, Abdullah M.; Heller, Harry G.; Hughes, David S.; Hursthouse, Michael B.; Kendrick, John; Leusen, Frank Jj; Montis, Riccardo","A mechanophysical phase transition provides a dramatic example of colour polymorphism: the tribochromism of a substituted tri(methylene)tetrahydrofuran-2-one.","Chemistry Central journal","2014","8","1","70","","10.1186/s13065-014-0070-3","","","0.71069","MoKα","","0.2359","0.089","","","0.2072","0.245","","","","","","0.727","","","","has coordinates","301776","2025-08-18","14:47:53",""
"1518516","20.349","0.002","10.095","0.002","21.338","0.002","90","","99.06","0.018","90","","4328.6","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","TriboIIIb","","","- C27 H20 N2 O2 -","- C27 H20 N2 O2 -","- C216 H160 N16 O16 -","8","1","","Asiri, Abdullah M.; Heller, Harry G.; Hughes, David S.; Hursthouse, Michael B.; Kendrick, John; Leusen, Frank Jj; Montis, Riccardo","A mechanophysical phase transition provides a dramatic example of colour polymorphism: the tribochromism of a substituted tri(methylene)tetrahydrofuran-2-one.","Chemistry Central journal","2014","8","1","70","","10.1186/s13065-014-0070-3","","","0.71069","MoKα","","0.1348","0.0616","","","0.1593","0.2199","","","","","","0.594","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518517","10.352","0.0004","7.212","0.0001","13.32","0.0009","90","","110.332","0.002","90","","932.49","0.07","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","TriboI","","","- C23 H16 N2 O2 -","- C23 H16 N2 O2 -","- C46 H32 N4 O4 -","2","1","","Asiri, Abdullah M.; Heller, Harry G.; Hughes, David S.; Hursthouse, Michael B.; Kendrick, John; Leusen, Frank Jj; Montis, Riccardo","A mechanophysical phase transition provides a dramatic example of colour polymorphism: the tribochromism of a substituted tri(methylene)tetrahydrofuran-2-one.","Chemistry Central journal","2014","8","1","70","","10.1186/s13065-014-0070-3","","","0.71069","MoKα","","0.0587","0.0423","","","0.1264","0.1431","","","","","","0.485","","","","has coordinates","301776","2025-08-18","14:47:53",""
"1547180","13.3686","0.0005","10.4704","0.0004","8.7799","0.0003","90","","90","","90","","1228.96","0.08","120","2","120","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","1","","Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu","Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O]","Chemistry Central Journal","2007","1","","20","","10.1186/1752-153X-1-20","","","0.71073","MoKα","","0.0286","0.0253","","","0.0615","0.0631","","","","","","0.922","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547181","13.4804","0.0014","10.6442","0.0009","8.8479","0.0007","90","","90","","90","","1269.6","0.2","274","2","274","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","1","","Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu","Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O]","Chemistry Central Journal","2007","1","","20","","10.1186/1752-153X-1-20","","","0.71073","MoKα","","0.038","0.0334","","","0.0871","0.0905","","","","","","1.047","","","","has coordinates","200921","2020-10-21","18:00:00",""
"1547182","10.666","0.002","13.489","0.003","8.8593","0.0018","90","","90","","90","","1274.6","0.5","293","2","293","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","0.5","","Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu","Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O]","Chemistry Central Journal","2007","1","","20","","10.1186/1752-153X-1-20","","","0.71073","MoKα","","0.0479","0.0366","","","0.0877","0.0933","","","","","","1.047","","","","has coordinates","200922","2020-10-21","18:00:00",""
"1547183","6.357","0.0003","7.2377","0.0003","16.7375","0.0007","80.359","0.003","82.469","0.003","72.36","0.003","720.87","0.06","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Hamada_F8_30_09_12_a","","","- C15 H10 Cl2 N2 O2 -","- C15 H10 Cl2 N2 O2 -","- C30 H20 Cl4 N4 O4 -","2","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","1.54178","CuKα","","0.0457","0.0424","","","0.1442","0.1474","","","","","","1.9","","","","has coordinates","200923","2020-10-21","18:00:00",""
"1547184","6.0147","0.0002","7.3767","0.0002","16.5968","0.0004","80.941","0.002","85.362","0.001","67.694","0.001","672.6","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Hamada_F4_20_05_12","","","- C15 H11 Cl N2 O2 -","- C15 H11 Cl N2 O2 -","- C30 H22 Cl2 N4 O4 -","2","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","1.54178","","","0.0379","0.0359","","","0.1016","0.1035","","","","","","1.063","","","","has coordinates","200924","2020-10-21","18:00:00",""
"1547185","7.7965","0.0011","11.0035","0.0013","12.2289","0.0017","70.789","0.008","89.602","0.007","85.231","0.007","987","0.2","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 Cl2 N4 O2 -","- C20 H16 Cl2 N4 O2 -","- C40 H32 Cl4 N8 O4 -","2","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","0.71075","MoKα","","","0.0641","","","","0.2135","","","","","","0.874","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547186","27.918","0.004","6.6325","0.0008","24.125","0.003","90","","113.965","0.009","90","","4082","1","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Hamada_F24_22_04_12","","","- C20 H16 Cl N5 O4 -","- C20 H16 Cl N5 O4 -","- C160 H128 Cl8 N40 O32 -","8","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","1.54178","CuKα","","0.1154","0.0781","","","0.1746","0.1984","","","","","","1.109","","","","has coordinates,has disorder","301779","2025-08-18","16:06:52",""
"1547187","7.5481","0.0006","21.3823","0.0013","27.862","0.002","90","","90","","90","","4496.8","0.6","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H20 Cl2 N4 O4 -","- C22 H20 Cl2 N4 O4 -","- C176 H160 Cl16 N32 O32 -","8","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","0.71075","MoKα","","","0.067","","","","0.1965","","","","","","0.998","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547188","8.918","0.001","10.6964","0.0011","13.2165","0.0014","73.044","0.006","81.609","0.006","70.078","0.005","1132.2","0.2","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H16 Cl2 N6 O3 S -","- C20 H16 Cl2 N6 O3 S -","- C40 H32 Cl4 N12 O6 S2 -","2","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","0.71075","MoKα","","","0.0471","","","","0.1891","","","","","","1.122","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547189","9.8702","0.0007","18.7297","0.0014","19.4912","0.0015","90","","92.397","0.004","90","","3600.1","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Hamada_F6_14_03_12","","","- C20 H15 Cl N2 O4 -","- C20 H15 Cl N2 O4 -","- C160 H120 Cl8 N16 O32 -","8","2","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","1.54178","CuKα","","0.0685","0.0468","","","0.1277","0.1346","","","","","","1.054","","","","has coordinates,has disorder","301779","2025-08-18","16:06:52",""
"1547190","26.252","0.002","7.3051","0.0005","24.0223","0.0018","90","","90","","90","","4606.8","0.6","293","","293","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C22 H17 Cl2 N5 O5 -","- C22 H17 Cl2 N5 O5 -","- C176 H136 Cl16 N40 O40 -","8","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","0.71075","MoKα","","","0.0585","","","","0.1531","","","","","","0.961","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547191","8.0271","0.001","14.5864","0.0013","21.531","0.003","90","","97.548","0.007","90","","2499.1","0.5","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 Cl2 N5 O6 -","- C24 H19 Cl2 N5 O6 -","- C96 H76 Cl8 N20 O24 -","4","1","","Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi","Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents","Chemistry Central Journal","2013","7","","123","","10.1186/1752-153X-7-123","","","0.71075","MoKα","","","0.0458","","","","0.1531","","","","","","1.098","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547192","7.60872","0.00014","10.09635","0.00018","11.4337","0.0002","72.858","0.005","88.015","0.007","82.627","0.006","832.38","0.04","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 N2 Na2 O11 -","- C14 H4 N2 Na2 O11 -","- C28 H8 N4 Na4 O22 -","2","1","","Kazuto Ikemoto; Hitoshi Sakamoto; Masahiko Nakano","Crystal structure and characterization of pyrroloquinoline quinone disodium trihydrate","Chemistry Central Journal","2012","6","","57","","10.1186/1752-153X-6-57","","","1.54187","CuKα","","","0.0475","","","","0.1429","","","","","","1.085","","","","has coordinates","200932","2020-10-21","18:00:00",""
"1547201","7.3859","0.0003","20.6898","0.0009","12.4157","0.0006","90","","90.165","0.001","90","","1897.27","0.15","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H34 O3 -","- C21 H34 O3 -","- C84 H136 O12 -","4","2","","Naik Tameen Khan; Marium Bibi; Sammer Yousuf; Izhar Husain Qureshi; Atta-ur-Rahman; Abdullah Mohammad Al-Majid; Muhammad Ahmed Mesaik; Ahmed Shukralla Khalid; Samina A Sattar; Atia-tul-Wahab; M Iqbal Choudhary","Synthesis of some potent immunomodulatory and anti-inflammatory metabolites by fungal transformation of anabolic steroid oxymetholone","Chemistry Central Journal","2012","6","","153","","10.1186/1752-153X-6-153","","","0.71073","MoKα","","0.0695","0.0523","","","0.1308","0.1429","","","","","","1.014","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547202","7.715","0.004","13.604","0.007","36.769","0.016","90","","90","","90","","3859","3","297","2","297","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 O3 -","- C21 H32 O3 -","- C168 H256 O24 -","8","2","","Naik Tameen Khan; Marium Bibi; Sammer Yousuf; Izhar Husain Qureshi; Atta-ur-Rahman; Abdullah Mohammad Al-Majid; Muhammad Ahmed Mesaik; Ahmed Shukralla Khalid; Samina A Sattar; Atia-tul-Wahab; M Iqbal Choudhary","Synthesis of some potent immunomodulatory and anti-inflammatory metabolites by fungal transformation of anabolic steroid oxymetholone","Chemistry Central Journal","2012","6","","153","","10.1186/1752-153X-6-153","","","0.71073","MoKα","","0.121","0.061","","","0.1293","0.1691","","","","","","1.033","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547203","7.7609","0.0005","13.2141","0.0008","18.6769","0.0011","90","","92.246","0.001","90","","1913.9","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H31 O4 -","- C21 H31 O3.75 -","- C84 H124 O15 -","4","2","","Naik Tameen Khan; Marium Bibi; Sammer Yousuf; Izhar Husain Qureshi; Atta-ur-Rahman; Abdullah Mohammad Al-Majid; Muhammad Ahmed Mesaik; Ahmed Shukralla Khalid; Samina A Sattar; Atia-tul-Wahab; M Iqbal Choudhary","Synthesis of some potent immunomodulatory and anti-inflammatory metabolites by fungal transformation of anabolic steroid oxymetholone","Chemistry Central Journal","2012","6","","153","","10.1186/1752-153X-6-153","","","0.71073","MoKα","","0.0699","0.0523","","","0.1342","0.1544","","","","","","1.053","","","","has coordinates,has disorder","216710","2020-10-21","18:00:00",""
"1547204","11.5169","0.0019","6.7843","0.0012","12.82","0.002","90","","109.27","0.004","90","","945.6","0.3","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H35 O4 -","- C20 H35 O4 -","- C40 H70 O8 -","2","1","","Naik Tameen Khan; Marium Bibi; Sammer Yousuf; Izhar Husain Qureshi; Atta-ur-Rahman; Abdullah Mohammad Al-Majid; Muhammad Ahmed Mesaik; Ahmed Shukralla Khalid; Samina A Sattar; Atia-tul-Wahab; M Iqbal Choudhary","Synthesis of some potent immunomodulatory and anti-inflammatory metabolites by fungal transformation of anabolic steroid oxymetholone","Chemistry Central Journal","2012","6","","153","","10.1186/1752-153X-6-153","","","0.71073","MoKα","","0.0791","0.0452","","","0.0808","0.0914","","","","","","0.873","","","","has coordinates","200969","2020-10-21","18:00:00",""
"1547206","8.002","0.0008","9.498","0.001","11.6401","0.0012","81.034","0.008","77.83","0.008","73.12","0.008","823.29","0.15","210","2","210","2","","","","","","","","7","P -1","-P 1","2","","Bis[tris(2-hydroxyethyl)amine]-nickel(II)- bis-[(4-chlorophenylsulfanyl)acetate]","","- C28 H42 Cl2 N2 Ni O10 S2 -","- C28 H42 Cl2 N2 Ni O10 S2 -","- C28 H42 Cl2 N2 Ni O10 S2 -","1","0.5","","Adamovich, S. N.; Mirskova, A. N.; Mirskov, R. G.; Schilde, Uwe","Reaction of pharmacological active tris-(2-hydroxyethyl)ammonium 4-chlorophenylsulfanylacetate with ZnCl2 or NiCl2: First conversion of a protic ionic liquid into metallated ionic liquid","Chemistry Central Journal","2013","7","","34","","10.1186/1752-153X-7-34","","","0.71073","MoKα","","0.0445","0.03","","","0.0575","0.0603","","","","","","0.964","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547207","8.2822","0.0002","16.5364","0.0003","14.5365","0.0003","90","","91.988","0.0019","90","","1989.69","0.07","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H28 Co Fe N12 O2 -","- C12 H28 Co Fe N12 O2 -","- C48 H112 Co4 Fe4 N48 O8 -","4","1","","Zdenek Travnicek; Radek Zboril; Miroslava Matikova-Malarova; Bohuslav Drahos; Juraj Cernak","Thermal decomposition of [Co(en)3][Fe(CN)6].2H2O: Topotactic dehydration process, valence and spin exchange mechanism elucidation","Chemistry Central Journal","2013","7","","28","","10.1186/1752-153X-7-28","","","0.71073","MoKα","","0.0354","0.0265","","","0.0807","0.0976","","","","","","1.169","","","","has coordinates","200972","2020-10-21","18:00:00",""
"1547208","15.0448","0.0003","8.4631","0.0002","14.9812","0.0003","90","","90.1603","0.0019","90","","1907.48","0.07","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H50 Co2 Fe2 N24 O -","- C24 H50 Co2 Fe2 N24 O -","- C48 H100 Co4 Fe4 N48 O2 -","2","0.5","","Zdenek Travnicek; Radek Zboril; Miroslava Matikova-Malarova; Bohuslav Drahos; Juraj Cernak","Thermal decomposition of [Co(en)3][Fe(CN)6].2H2O: Topotactic dehydration process, valence and spin exchange mechanism elucidation","Chemistry Central Journal","2013","7","","28","","10.1186/1752-153X-7-28","","","0.71073","MoKα","","0.0333","0.0263","","","0.0796","0.0948","","","","","","1.246","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547209","9.699","0.001","8.5","0.001","18.044","0.002","90","","101.29","0.007","90","","1458.8","0.3","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O S -","- C16 H15 N3 O S -","- C64 H60 N12 O4 S4 -","4","1","","Behrooz Rezaei; Mehrnoosh Fazlollahi","Synthesis, solvatochromism and crystal structure of 5-Methoxy-5,6-diphenyl-4,5-dihydro-2H -1,2,4-triazine-3-thione","Chemistry Central Journal","2013","7","","130","","10.1186/1752-153X-7-130","","","0.71069","MoKα","","0.0391","0.0371","","","0.1008","0.1024","","","","","","1.062","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547210","7.4432","0.0015","9.993","0.002","16.648","0.003","77.55","0.02","87.54","0.03","87.09","0.03","1206.9","0.4","180","2","180","2","","","","","","","","3","P -1","-P 1","2","Triamterene","6-phenylpteridine-2,4,7-triamine","","- C12 H11 N7 -","- C12 H11 N7 -","- C48 H44 N28 -","4","2","","Rehman, A.; Delori, A.; Hughes, D. S.; Jones, W.","Using crystallography, topology and graph set analysis for the description of the hydrogen bond network of triamterene: A rational approach to solid form selection","Chemistry Central Journal","2017","63","","11","","10.1186/s13065-017-0293-1","","","1.54178","CuKα","","0.0457","0.036","","","0.0917","0.0984","","","","","","1.032","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547211","11.198","0.0005","12.291","0.0008","13.361","0.0004","93.151","0.005","97.65","0.003","92.66","0.004","1817.13","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H22 N2 O -","- C19 H22 N2 O -","- C76 H88 N8 O4 -","4","2","","Maheshwaran Velusamy; Sethuvasan Sreenivasan; Ravichandran Kandasamy; Ponnuswamy Subbu; Sugumar Paramasivam; Ponnuswamy Mondikalipudur Nanjappagounder","Synthesis, crystal structures and docking studies of 2,7-diphenyl-1,4-diazepan-5-one derivatives","Chemistry Central Journal","2015","9","","17","","10.1186/s13065-015-0094-3","","","0.71073","MoKα","","0.1369","0.0595","","","0.1687","0.1912","","","","","","0.957","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547212","9.1789","0.0006","12.7776","0.0009","16.0615","0.001","89.255","0.004","86.758","0.004","70.507","0.004","1772.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H21 N3 O2 -","- C19 H21 N3 O2 -","- C76 H84 N12 O8 -","4","2","","Maheshwaran Velusamy; Sethuvasan Sreenivasan; Ravichandran Kandasamy; Ponnuswamy Subbu; Sugumar Paramasivam; Ponnuswamy Mondikalipudur Nanjappagounder","Synthesis, crystal structures and docking studies of 2,7-diphenyl-1,4-diazepan-5-one derivatives","Chemistry Central Journal","2015","9","","17","","10.1186/s13065-015-0094-3","","","0.71073","MoKα","","0.1163","0.057","","","0.1479","0.1919","","","","","","0.997","","","","has coordinates,has disorder","301779","2025-08-18","16:06:52",""
"1547213","12.7424","0.0009","17.4112","0.0007","21.0833","0.001","90","","90","","90","","4677.6","0.4","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H20 N12 O12 -","- C16 H20 N12 O12 -","- C128 H160 N96 O96 -","8","1","","Gustavo Portalone","Solid-phase molecular recognition of cytosine based on proton-transfer reaction. Part II. supramolecular architecture in the cocrystals of cytosine and its 5-Fluoroderivative with 5-Nitrouracil","Chemistry Central Journal","2011","5","","51","","10.1186/1752-153X-5-51","","","0.71069","MoKα","","0.1339","0.0801","","","0.1233","0.1386","","","","","","1.164","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547214","10.2066","0.0006","28.2758","0.0011","4.7187","0.0003","90","","111.293","0.006","90","","1268.85","0.13","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C8 H11 F N6 O7 -","- C8 H11 F N6 O7 -","- C32 H44 F4 N24 O28 -","4","1","","Gustavo Portalone","Solid-phase molecular recognition of cytosine based on proton-transfer reaction. Part II. supramolecular architecture in the cocrystals of cytosine and its 5-Fluoroderivative with 5-Nitrouracil","Chemistry Central Journal","2011","5","","51","","10.1186/1752-153X-5-51","","","0.71069","MoKα","","0.068","0.067","","","0.1533","0.1535","","","","","","1.473","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547215","10.2944","0.0001","13.6664","0.0002","19.4983","0.0002","90","","90","","90","","2743.16","0.06","130","2","130","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H46 N O2 P S2 -","- C24 H46 N O2 P S2 -","- C96 H184 N4 O8 P4 S8 -","4","1","","Samet Solak; Cemal Aydemir; Mehmet Karakus; Peter Lonnecke","Novel Gold(I) and Silver(I) Complexes of Phosphorus-1,1,-dithiolates and Molecular Structure of [O,O'-(Bornyl)2PS2]H3NC(CH3)3","Chemistry Central Journal","2013","7","","89","","10.1186/1752-153X-7-89","","","0.71073","MoKα","","0.0403","0.0348","","","0.0909","0.0925","","","","","","0.997","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547244","11.234","0.0014","12.431","0.0017","13.347","0.0012","83.037","0.007","71.297","0.006","89.54","0.005","1751.5","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H56 N2 O4 Ti -","- C35 H56 N2 O4 Ti -","- C70 H112 N4 O8 Ti2 -","2","1","","Stuart L Hancock; Mary F. Mahon; Matthew D. Jones","Monomeric Ti(IV) Homopiperazine Complexes and their Exploitation for the Ring Opening Polymerisation of rac-Lactide","Chemistry Central Journal","2013","7","","135","","10.1186/1752-153X-7-135","","","0.71073","MoKα","","0.1066","0.0564","","","0.1265","0.1497","","","","","","1.034","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547245","19.372","0.0007","9.652","0.0004","20.395","0.001","90","","116.015","0.002","90","","3427","0.3","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C35 H56 N2 O4 Ti -","- C35 H56 N2 O4 Ti -","- C140 H224 N8 O16 Ti4 -","4","1","","Stuart L Hancock; Mary F. Mahon; Matthew D. Jones","Monomeric Ti(IV) Homopiperazine Complexes and their Exploitation for the Ring Opening Polymerisation of rac-Lactide","Chemistry Central Journal","2013","7","","135","","10.1186/1752-153X-7-135","","","0.71073","MoKα","","0.1272","0.0837","","","0.196","0.2254","","","","","","1.079","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547246","10.925","0.0007","14.72","0.0012","27.104","0.0014","90","","90","","90","","4358.8","0.5","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C45 H76 N2 O4 Ti -","- C45 H76 N2 O4 Ti -","- C180 H304 N8 O16 Ti4 -","4","1","","Stuart L Hancock; Mary F. Mahon; Matthew D. Jones","Monomeric Ti(IV) Homopiperazine Complexes and their Exploitation for the Ring Opening Polymerisation of rac-Lactide","Chemistry Central Journal","2013","7","","135","","10.1186/1752-153X-7-135","","","0.71073","MoKα","","0.0918","0.0607","","","0.1452","0.1651","","","","","","1.039","","","","has coordinates,has disorder","301779","2025-08-18","16:06:52",""
"1547247","14.053","0.0002","13.582","0.0002","20.148","0.0004","90","","91.528","0.001","90","","3844.24","0.11","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H60 N2 O4 Ti -","- C40 H60 N2 O4 Ti -","- C160 H240 N8 O16 Ti4 -","4","1","","Stuart L Hancock; Mary F. Mahon; Matthew D. Jones","Monomeric Ti(IV) Homopiperazine Complexes and their Exploitation for the Ring Opening Polymerisation of rac-Lactide","Chemistry Central Journal","2013","7","","135","","10.1186/1752-153X-7-135","","","0.71073","MoKα","","0.083","0.0503","","","0.1156","0.1348","","","","","","1.027","","","","has coordinates,has disorder","201066","2020-10-21","18:00:00",""
"1547248","10.2783","0.0003","13.6919","0.0003","15.4164","0.0004","102.863","0.002","102.187","0.002","108.805","0.002","1905.83","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Pyrimethamine benzene sulfonate monohydrate","'2,4-diamino-5-(p-chlorophenyl)-6-ethylpyrimidinium benzene sulfonate monohydrate'","","- C72 H76 Cl4 N16 O14 S4 -","- C72 H76 Cl4 N16 O12.82 S4 -","- C72 H76 Cl4 N16 O12.82 S4 -","1","0.5","","Kasthuri Balasubramani; Packianathan Thomas Muthiah; Daniel E Lynch","R22(8) motifs in Aminopyrimidine sulfonate/carboxylate interactions: Crystal structures of pyrimethaminium benzenesulfonate monohydrate (2:2:1) and 2-amino-4,6-dimethylpyrimidinium sulfosalicylate dihydrate (4:2:2)","Chemistry Central Journal","2007","1","","28","","10.1186/1752-153X-1-28","","","0.71073","MoKα","","0.0954","0.0509","","","0.1146","0.1314","","","","","","1.057","","","","has coordinates","201067","2020-10-21","18:00:00",""
"1547249","9.2466","0.0002","14.0976","0.0003","17.6365","0.0004","94.028","0.001","101.193","0.001","91.968","0.001","2247","0.09","120","2","120","2","","","","","","","","5","P -1","-P 1","2","tetra(2-amino-4,6-dimethylpyrimidinium) bis(sulfosalicylate) dihydrate","'tetra(2-amino-4,6-dimethylpyrimidinium) bis(sulfosalicylate) dihydrate'","","- C19 H25 N6 O7 S -","- C19 H25 N6 O7 S -","- C76 H100 N24 O28 S4 -","4","2","","Kasthuri Balasubramani; Packianathan Thomas Muthiah; Daniel E Lynch","R22(8) motifs in Aminopyrimidine sulfonate/carboxylate interactions: Crystal structures of pyrimethaminium benzenesulfonate monohydrate (2:2:1) and 2-amino-4,6-dimethylpyrimidinium sulfosalicylate dihydrate (4:2:2)","Chemistry Central Journal","2007","1","","28","","10.1186/1752-153X-1-28","","","0.71073","MoKα","","0.076","0.0592","","","0.1407","0.1518","","","","","","1.084","","","","has coordinates","214153","2020-10-21","18:00:00",""
"1547250","10.3809","0.0002","11.7017","0.0003","11.3918","0.0002","90","","91.742","0.001","90","","1383.17","0.05","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H36 Br2 N4 O2 -","- C28 H36 Br2 N4 O2 -","- C56 H72 Br4 N8 O4 -","2","1","","Muhammad Adnan Iqbal; Rosenani A Haque; Siti Fatimah Nasri; AMS Abdul Majid; Mohamed B Khadeer Ahamed; Elham Farsi; Tabinda Fatima","Potential of silver against human colon cancer: (synthesis, characterization and crystal structures of xylyl (Ortho, meta, & Para) linked bis-benzimidazolium salts and Ag(I)-NHC complexes: In vitroanticancer studies)","Chemistry Central Journal","2013","7","","27","","10.1186/1752-153X-7-27","","","0.71073","MoKα","","0.0457","0.0334","","","0.0598","0.063","","","","","","0.934","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547251","16.3719","0.0004","10.0392","0.0002","19.1499","0.0004","90","","96.896","0.001","90","","3124.72","0.12","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 F12 N4 P2 -","- C28 H32 F12 N4 P2 -","- C112 H128 F48 N16 P8 -","4","1","","Muhammad Adnan Iqbal; Rosenani A Haque; Siti Fatimah Nasri; AMS Abdul Majid; Mohamed B Khadeer Ahamed; Elham Farsi; Tabinda Fatima","Potential of silver against human colon cancer: (synthesis, characterization and crystal structures of xylyl (Ortho, meta, & Para) linked bis-benzimidazolium salts and Ag(I)-NHC complexes: In vitroanticancer studies)","Chemistry Central Journal","2013","7","","27","","10.1186/1752-153X-7-27","","","0.71073","MoKα","","0.0707","0.0522","","","0.1309","0.1531","","","","","","1.041","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547252","12.0379","0.0006","10.2165","0.0005","12.7232","0.0006","90","","96.236","0.001","90","","1555.51","0.13","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H32 F12 N4 P2 -","- C28 H32 F12 N4 P2 -","- C56 H64 F24 N8 P4 -","2","0.5","","Muhammad Adnan Iqbal; Rosenani A Haque; Siti Fatimah Nasri; AMS Abdul Majid; Mohamed B Khadeer Ahamed; Elham Farsi; Tabinda Fatima","Potential of silver against human colon cancer: (synthesis, characterization and crystal structures of xylyl (Ortho, meta, & Para) linked bis-benzimidazolium salts and Ag(I)-NHC complexes: In vitroanticancer studies)","Chemistry Central Journal","2013","7","","27","","10.1186/1752-153X-7-27","","","0.71073","MoKα","","0.0456","0.037","","","0.1068","0.1134","","","","","","1.043","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547253","11.0707","0.0003","11.3028","0.0003","14.8929","0.0003","84.963","0.001","75.975","0.001","87.924","0.001","1800.8","0.08","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H32 Br2 N4 -","- C36 H32 Br2 N4 -","- C72 H64 Br4 N8 -","2","1","","Rosenani A Haque; Muhammad Adnan Iqbal; Mohamed B Khadeer Ahamed; AMS Abdul Majid; Zena A Abdul Hameed","Design, synthesis and structural studies of meta-xylyl linked bis-benzimidazolium salts: potential anticancer agents against human colon cancer","Chemistry Central Journal","2012","6","","68","","10.1186/1752-153X-6-68","","","0.71073","MoKα","","0.0638","0.0472","","","0.1305","0.1376","","","","","","1.076","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547254","16.452","0.0009","12.0683","0.0007","16.298","0.0009","90","","103.064","0.001","90","","3152.2","0.3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C28 H32 F12 N4 P2 -","- C28 H32 F12 N4 P2 -","- C112 H128 F48 N16 P8 -","4","1","","Rosenani A Haque; Muhammad Adnan Iqbal; Mohamed B Khadeer Ahamed; AMS Abdul Majid; Zena A Abdul Hameed","Design, synthesis and structural studies of meta-xylyl linked bis-benzimidazolium salts: potential anticancer agents against human colon cancer","Chemistry Central Journal","2012","6","","68","","10.1186/1752-153X-6-68","","","0.71073","MoKα","","0.0546","0.0424","","","0.1187","0.1293","","","","","","1.029","","","","has coordinates,has disorder","301779","2025-08-18","16:06:52",""
"1547255","8.106","0.0001","10.241","0.0003","12.952","0.0004","90","","90","","90","","1075.19","0.05","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 O5 -","- C10 H14 O5 -","- C40 H56 O20 -","4","1","","Van der Waals, Dominic; Pugh, Thomas; Ali Kahn, Monica; Stewart, Alan J. W.; Johnson, Andrew L.; Lewis, Simon E.","A Cobalt Complex of a Microbial Arene Oxidation Product","Chemistry Central Journal","2011","5","","80","","10.1186/1752-153X-5-80","","","0.71073","MoKα","","0.0419","0.0322","","","0.0712","0.0754","","","","","","1.031","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547256","7.305","0.0001","8.665","0.0001","23.568","0.0003","90","","90","","90","","1491.8","0.03","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 Co O4 -","- C16 H19 Co O4 -","- C64 H76 Co4 O16 -","4","1","","Van der Waals, Dominic; Pugh, Thomas; Ali Kahn, Monica; Stewart, Alan J. W.; Johnson, Andrew L.; Lewis, Simon E.","A Cobalt Complex of a Microbial Arene Oxidation Product","Chemistry Central Journal","2011","5","","80","","10.1186/1752-153X-5-80","","","0.71073","mokα","","0.0291","0.0274","","","0.062","0.0625","","","","","","1.231","","","","has coordinates","201075","2020-10-21","18:00:00",""
"1547257","9.5682","0.0002","15.8094","0.0004","13.5902","0.0002","90","","99.76","0.001","90","","2026","0.07","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 O6 -","- C23 H24 O6 -","- C92 H96 O24 -","4","1","","Petra Galer; Amalija Golobic; Joze Koller; Berta Kosmrlj; Boris Sket","Structures in solid state and solution of dimethoxy curcuminoids: regioselective bromination and chlorination","Chemistry Central Journal","2013","7","","107","","10.1186/1752-153X-7-107","","","0.71069","MoKα","","0.1058","0.0671","","","0.1655","0.2056","","","","","","1.094","","","","has coordinates","201076","2020-10-21","18:00:00",""
"1547258","30.699","0.005","8.444","0.005","8.788","0.005","90","","90","","90","","2278","1.9","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C24 H24 O7 -","- C24 H24 O7 -","- C96 H96 O28 -","4","0.5","","Petra Galer; Amalija Golobic; Joze Koller; Berta Kosmrlj; Boris Sket","Structures in solid state and solution of dimethoxy curcuminoids: regioselective bromination and chlorination","Chemistry Central Journal","2013","7","","107","","10.1186/1752-153X-7-107","","","0.71072","MoKα","","0.0891","0.0701","","","0.2122","0.231","","","","","","1.053","","","","has coordinates","201077","2020-10-21","18:00:00",""
"1547259","7.9853","0.0003","27.0569","0.0008","19.2058","0.0005","90","","101.888","0.003","90","","4060.6","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 O6 -","- C23 H24 O6 -","- C184 H192 O48 -","8","2","","Petra Galer; Amalija Golobic; Joze Koller; Berta Kosmrlj; Boris Sket","Structures in solid state and solution of dimethoxy curcuminoids: regioselective bromination and chlorination","Chemistry Central Journal","2013","7","","107","","10.1186/1752-153X-7-107","","","0.71073","MoKα","","0.1256","0.0642","","","0.162","0.1897","","","","","","1.058","","","","has coordinates","201078","2020-10-21","18:00:00",""
"1547260","10.8388","0.0003","8.8885","0.0003","22.1827","0.0007","90","","100.433","0.003","90","","2101.76","0.12","291","2","291","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","3-nitroso-2-phenylimidazo[1,2-a]pyridine","","- C13 H9 N3 O -","- C13 H9 N3 O -","- C104 H72 N24 O8 -","8","2","","Manuel Velazquez-Ponce; Hector Salgado-Zamora; Hugo A Jimenez-Vazquez; Maria Elena Campos-Aldrete; Rogelio Jimenez; Humberto Cervantes; Taibi Ben Hadda","Intramolecular H-bonding interaction in angular 3-pi-EWG substituted imidazo[1,2-a]pyridines contributes to conformational preference","Chemistry Central Journal","2013","7","","20","","10.1186/1752-153X-7-20","","x-ray","0.71073","MoKα","","0.1249","0.0754","","","0.134","0.1481","","","","","","1.125","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547261","9.4583","0.0019","10.494","0.002","11.545","0.002","70.49","0.03","73.27","0.03","64","0.03","957.2","0.4","","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H23 Cl N2 O2 -","- C20 H23 Cl N2 O2 -","- C40 H46 Cl2 N4 O4 -","2","1","","Rui Wu; Cong Zhu; Xiu-Jiang Du; Li-Xia Xiong; Shu-Jing Yu; Xing-Hai Liu; Zheng-Ming Li; Wei-Guang Zhao","Synthesis, crystal structure and larvicidal activity of novel diamide derivatives against Culex pipiens","Chemistry Central Journal","2012","6","","99","","10.1186/1752-153X-6-99","","x-ray","0.71073","MoKα","","0.1115","0.0476","","","0.0971","0.1174","","","","","","1.043","","","","has coordinates","211137","2020-10-21","18:00:00",""
"1547267","8.3512","0.0009","12.56","0.0013","15.3638","0.0016","90","","90","","90","","1611.5","0.3","180.01","0.1","180.01","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 N3 O -","- C20 H19 N3 O -","- C80 H76 N12 O4 -","4","1","","Peng Lei; Xuebo Zhang; Yan Xu; Gaofei Xu; Xili Liu; Xinling Yang; Xiaohe Zhang; Yun Ling","Synthesis and fungicidal activity of pyrazole derivatives containing 1,2,3,4-tetrahydroquinoline","Chemistry Central Journal","2016","10","","40","","10.1186/s13065-016-0186-8","","","0.7107","MoKα","","0.046","0.0369","","","0.0809","0.0852","","","","","","1.033","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547268","9.0486","0.0004","9.1081","0.0005","11.7993","0.0006","68.513","0.005","80.348","0.004","64.771","0.005","818.47","0.08","123","","123","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H18 N4 S -","- C20 H18 N4 S -","- C40 H36 N8 S2 -","2","1","","Ahmed T. A. Boraei; El Sayed H. El Ashry; Axel Duerkop","Regioselectivity of the alkylation of S-substituted 1,2,4-triazoles with dihaloalkanes","Chemistry Central Journal","2016","10","","22","","10.1186/s13065-016-0165-0","","","1.54184","CuKα","","0.034","0.032","","","0.0822","0.084","","","","","","1.046","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547269","14.839","0.0002","11.3364","0.0001","17.8545","0.0002","90","","102.292","0.001","90","","2934.64","0.06","123","","123","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C35 H28 N8 S2 -","- C35 H28 N8 S2 -","- C140 H112 N32 S8 -","4","1","","Ahmed T. A. Boraei; El Sayed H. El Ashry; Axel Duerkop","Regioselectivity of the alkylation of S-substituted 1,2,4-triazoles with dihaloalkanes","Chemistry Central Journal","2016","10","","22","","10.1186/s13065-016-0165-0","","","1.54184","CuKα","","0.0428","0.0388","","","0.1015","0.1058","","","","","","1.049","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547270","32.9005","0.0005","8.0484","0.00012","11.51861","0.00019","90","","106.019","0.0017","90","","2931.65","0.08","123","","123","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H28 N8 S2 -","- C35 H28 N8 S2 -","- C140 H112 N32 S8 -","4","0.5","","Ahmed T. A. Boraei; El Sayed H. El Ashry; Axel Duerkop","Regioselectivity of the alkylation of S-substituted 1,2,4-triazoles with dihaloalkanes","Chemistry Central Journal","2016","10","","22","","10.1186/s13065-016-0165-0","","","0.71069","MoKα","","0.0328","0.0317","","","0.0841","0.0852","","","","","","1.033","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547271","9.13384","0.00013","21.768","0.0003","9.47711","0.00013","90","","93.8246","0.0013","90","","1880.09","0.05","123","","123.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Br N4 S -","- C20 H19 Br N4 S -","- C80 H76 Br4 N16 S4 -","4","1","","Ahmed T. A. Boraei; El Sayed H. El Ashry; Axel Duerkop","Regioselectivity of the alkylation of S-substituted 1,2,4-triazoles with dihaloalkanes","Chemistry Central Journal","2016","10","","22","","10.1186/s13065-016-0165-0","","","1.54184","CuKα","","0.0356","0.0293","","","0.0776","0.0802","","","","","","1.072","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547272","8.3072","0.0011","13.5441","0.0019","17.41","0.002","90","","92.275","0.012","90","","1957.3","0.4","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","2-(10-Hexyl-10H-phenothiazin-3-ylmethylene)-malononitrile","2-(10-Hexyl-10H-phenothiazin-3-ylmethylene)-malononitrile","","- C22 H21 N3 S -","- C22 H21 N3 S -","- C88 H84 N12 S4 -","4","1","","Fatimah Ali Al-Zahrani; Muhammad Nadeem Arshad; Abdullah M. Asiri; Tariq Mahmood; Mazhar Amjad Gilani; Reda M. El-shishtawy","Synthesis and structural properties of 2-((10-alkyl-10H-phenothiazin-3-yl)methylene)malononitrile derivatives; a combined experimental and theoretical insight","Chemistry Central Journal","2016","10","","13","","10.1186/s13065-016-0158-z","","","0.71073","MoKα","","0.2559","0.0659","","","0.1162","0.1809","","","","","","0.837","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547273","16.4823","0.0007","16.9423","0.0008","17.6368","0.0007","106.027","0.004","110.499","0.004","96.744","0.004","4306.6","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","2-(10-Octyl-10<i>H</i>-phenothiazin-3-ylmethylene)-malononitrile","2-(10-Octyl-10<i>H</i>-phenothiazin-3-ylmethylene)-malononitrile","","- C24 H25 N3 S -","- C24 H25 N3 S -","- C192 H200 N24 S8 -","8","4","","Fatimah Ali Al-Zahrani; Muhammad Nadeem Arshad; Abdullah M. Asiri; Tariq Mahmood; Mazhar Amjad Gilani; Reda M. El-shishtawy","Synthesis and structural properties of 2-((10-alkyl-10H-phenothiazin-3-yl)methylene)malononitrile derivatives; a combined experimental and theoretical insight","Chemistry Central Journal","2016","10","","13","","10.1186/s13065-016-0158-z","","","0.71073","MoKα","","0.2263","0.0752","","","0.1474","0.2185","","","","","","1.013","","","","has coordinates","301779","2025-08-18","16:06:52",""