Crystallography Open Database

Information card for entry 8103131

Preview

Coordinates	8103131.cif

Structure parameters

Chemical name	bis(2-benzoylbenzoato - k2O,O')- (2,2'-bipyridine-k2N,N')cadmium(II), Cd(C10H8N2)(C14H9O3)2
Formula	C38 H26 Cd N2 O6
Calculated formula	C38 H26 Cd N2 O6
Title of publication	Crystal structure of bis(2-benzoylbenzoato-k2O,O')-(2,2'-bipyridine-k2N,N')cadmium(II), Cd(C10H8N2)(C14H9O3)2
Authors of publication	Ying-Qun Yang; Zhi-Min Chen; Wei Li; Yun-Fei Kuang
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2011
Journal volume	226
Journal issue	1
Pages of publication	112
a	13.385 ± 0.003 Å
b	14.13 ± 0.003 Å
c	17.139 ± 0.003 Å
α	90°
β	90.66 ± 0.03°
γ	90°
Cell volume	3241.3 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0366
Residual factor for significantly intense reflections	0.0301
Weighted residual factors for significantly intense reflections	0.0704
Weighted residual factors for all reflections included in the refinement	0.0762
Goodness-of-fit parameter for all reflections included in the refinement	0.769
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
176728 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8103131.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8103131.cif
29091	2011-11-02	../uploads/cif-deposit/cod/cif Adding structures of 8103131 via cif-deposit CGI script.	8103131.cif