Crystallography Open Database

Information card for entry 4508772

Preview

Coordinates	4508772.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H36 Cd3 N2 O13
Calculated formula	C56 H36 Cd3 N2 O13
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	12.8165 ± 0.0008 Å
b	14.9807 ± 0.0009 Å
c	14.9864 ± 0.0009 Å
α	118.8 ± 0.001°
β	101.904 ± 0.001°
γ	95.427 ± 0.001°
Cell volume	2403.3 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0519
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0672
Weighted residual factors for all reflections included in the refinement	0.0706
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179623 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/87.	4508772.cif
96920	2014-01-29	cif/ Adding structures of 4508772 via cif-deposit CGI script.	4508772.cif