Crystallography Open Database

Information card for entry 4508771

Preview

Coordinates	4508771.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H48.5 Cd3 N4 O17.25
Calculated formula	C68 H48.5 Cd3 N4 O17.25
Title of publication	Syntheses, Structures, and Photoluminescence of Three Coordination Polymers of Cadmium Dicarboxylates
Authors of publication	Zhang, Ling-Yun; Zhang, Jie-Peng; Lin, Yan-Yong; Chen, Xiao-Ming
Journal of publication	Crystal Growth & Design
Year of publication	2006
Journal volume	6
Journal issue	7
Pages of publication	1684
a	31.0998 ± 0.0015 Å
b	24.0457 ± 0.0012 Å
c	23.0064 ± 0.0011 Å
α	90°
β	131.42 ± 0.001°
γ	90°
Cell volume	12901.4 ± 1.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0479
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.1047
Weighted residual factors for all reflections included in the refinement	0.1097
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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.	4508771.cif
96919	2014-01-29	cif/ Adding structures of 4508771 via cif-deposit CGI script.	4508771.cif