Crystallography Open Database

Information card for entry 7210360

Preview

Coordinates	7210360.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H8 Cd N2 O2 S2
Calculated formula	C10 H8 Cd N2 O2 S2
Title of publication	Polymorphism in unusual one-dimensional coordination polymers based on cadmium(ii) and 2-mercaptopyridine N-oxide
Authors of publication	Zhang, Guoqi
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	33
Pages of publication	6453
a	3.8452 ± 0.0008 Å
b	18.753 ± 0.004 Å
c	8.0557 ± 0.0016 Å
α	90°
β	93.49 ± 0.03°
γ	90°
Cell volume	579.8 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0347
Residual factor for significantly intense reflections	0.0307
Weighted residual factors for significantly intense reflections	0.082
Weighted residual factors for all reflections included in the refinement	0.0844
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
180434 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/03.	7210360.cif
87606	2013-08-27	cif/ Adding structures of 7210359, 7210360 via cif-deposit CGI script.	7210360.cif