Crystallography Open Database

Information card for entry 4307018

Preview

Coordinates	4307018.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H67 F12 N11 O0.5 P2 Ru
Calculated formula	C54 H57 F12 N11 O0.5 P2 Ru
Title of publication	DNA Binding and Cytotoxicity of Ruthenium(II) and Rhenium(I) Complexes of 2-Amino-4-phenylamino-6-(2-pyridyl)-1,3,5-triazine
Authors of publication	Dik-Lung Ma; Chi-Ming Che; Fung-Ming Siu; Mengsu Yang; Kwok-Yin Wong
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	740 - 749
a	13.356 ± 0.003 Å
b	14.821 ± 0.003 Å
c	17.251 ± 0.004 Å
α	77.47 ± 0.03°
β	75.69 ± 0.03°
γ	67.17 ± 0.03°
Cell volume	3021.5 ± 1.4 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1188
Residual factor for significantly intense reflections	0.0955
Weighted residual factors for significantly intense reflections	0.2609
Weighted residual factors for all reflections included in the refinement	0.2897
Goodness-of-fit parameter for all reflections included in the refinement	1.138
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4307018.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307018.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307018.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307018.cif