Crystallography Open Database

Information card for entry 7220137

7220136 << 7220137 >> 7220138

Preview

Coordinates	7220137.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H17 Co N7 O S2
Calculated formula	C21 H13 Co N7 S2
Title of publication	Assembling mono-, di- and tri-nuclear coordination complexes with a ditopic analogue of 2,2':6',2''-terpyridine: syntheses, structures and catalytic studies
Authors of publication	Zhang, Guoqi; yin, zhiwei; Zheng, Shengping; Phoenix, Tonya; Fettinger, James C.
Journal of publication	RSC Adv.
Year of publication	2015
a	8.9547 ± 0.001 Å
b	10.2686 ± 0.0011 Å
c	12.4191 ± 0.0013 Å
α	86.077 ± 0.004°
β	86.323 ± 0.004°
γ	78.479 ± 0.004°
Cell volume	1114.8 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0496
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.0975
Weighted residual factors for all reflections included in the refinement	0.1027
Goodness-of-fit parameter for all reflections included in the refinement	1.039
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.	7220137.cif
135730	2015-05-08	cif/ Adding structures of 7220134, 7220135, 7220136, 7220137, 7220138, 7220139 via cif-deposit CGI script.	7220137.cif