Crystallography Open Database

Information card for entry 7221905

7221904 << 7221905 >> 7221906

Preview

Coordinates	7221905.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H66 Cd Mo16 N12 O58
Calculated formula	C42 H66 Cd Mo16 N12 O58
Title of publication	Four hybrid compounds based on new type of molybdates and a flexible tripodal ligand: synthesis, structures, photochemical and electrochemical properties
Authors of publication	Du, Hai-Juan; Wang, Chao-Hai; Li, Yao; Niu, Yunyin; Hou, Hongwei
Journal of publication	RSC Adv.
Year of publication	2015
a	10.9486 ± 0.0012 Å
b	11.2769 ± 0.0012 Å
c	17.9528 ± 0.0019 Å
α	100.409 ± 0.001°
β	96.42 ± 0.001°
γ	104.274 ± 0.001°
Cell volume	2084.2 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0328
Residual factor for significantly intense reflections	0.027
Weighted residual factors for significantly intense reflections	0.0677
Weighted residual factors for all reflections included in the refinement	0.0715
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7221905.cif
153720	2015-08-27	cif/ Adding structures of 7221903, 7221904, 7221905, 7221906 via cif-deposit CGI script.	7221905.cif