Crystallography Open Database

Information card for entry 4509864

Preview

Coordinates	4509864.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H66 Cd2 N8 O10 Zn0
Calculated formula	C74 H62 Cd2 N8 O10
Title of publication	A Systematic Research on the Synthesis, Structures, and Application in Photocatalysis of Cluster-Based Coordination Complexes
Authors of publication	Meng, Wei; Xu, Zhouqing; Ding, Jie; Wu, Dongqing; Han, Xiao; Hou, Hongwei; Fan, Yaoting
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	2
Pages of publication	730
a	45.787 ± 0.015 Å
b	16.599 ± 0.005 Å
c	17.858 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	13572 ± 8 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	6
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.1205
Residual factor for significantly intense reflections	0.1103
Weighted residual factors for significantly intense reflections	0.2665
Weighted residual factors for all reflections included in the refinement	0.2746
Goodness-of-fit parameter for all reflections included in the refinement	1.146
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179634 (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 4/50/98.	4509864.cif
104096	2014-03-10	cif/ Adding structures of 4509864 via cif-deposit CGI script.	4509864.cif