Crystallography Open Database

Information card for entry 4509251

Preview

Coordinates	4509251.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H42 Co2 N2 O12 S
Calculated formula	C35 H42 Co2 N2 O12 S
Title of publication	Two Coordination Polymers Involving Triangular and Linear Trinuclear Co(II) Clusters Created Via In situ Ligand Synthesis
Authors of publication	Ma, Lu-Fang; Wang, Yao-Yu; Wang, Li-Ya; Lu, Dan-Hua; Batten, Stuart. R.; Wang, Jian-Ge
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	5
Pages of publication	2036
a	9.5384 ± 0.0005 Å
b	12.1759 ± 0.0006 Å
c	19.313 ± 0.0013 Å
α	101.152 ± 0.001°
β	100.351 ± 0.001°
γ	105.304 ± 0.001°
Cell volume	2058.5 ± 0.2 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 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	0.0487
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.1175
Weighted residual factors for all reflections included in the refinement	0.1237
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
179628 (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 4/50/92.	4509251.cif
97178	2014-01-29	cif/ Adding structures of 4509250, 4509251 via cif-deposit CGI script.	4509251.cif