Crystallography Open Database

Information card for entry 4509250

Preview

Coordinates	4509250.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H50 Co3 N3 O13 S2
Calculated formula	C51 H50 Co3 N3 O13 S2
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	15.5075 ± 0.0011 Å
b	33.993 ± 0.002 Å
c	10.4725 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	5520.5 ± 0.7 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	18
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for all reflections	0.105
Residual factor for significantly intense reflections	0.0714
Weighted residual factors for significantly intense reflections	0.1666
Weighted residual factors for all reflections included in the refinement	0.1905
Goodness-of-fit parameter for all reflections included in the refinement	1.024
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.	4509250.cif
97178	2014-01-29	cif/ Adding structures of 4509250, 4509251 via cif-deposit CGI script.	4509250.cif