Crystallography Open Database

Information card for entry 4310273

Preview

Coordinates	4310273.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H8 Cu N5 S
Calculated formula	C13 H8 Cu N5 S
Title of publication	New 1- and 2-Dimensional Polymeric Structures of Cyanopyridine Complexes of AgI and CuI
Authors of publication	Ping Lin; Richard A. Henderson; Ross W. Harrington; William Clegg; Chuan-De Wu; Xin-Tao Wu
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	181 - 188
a	11.2816 ± 0.0007 Å
b	19.3224 ± 0.0011 Å
c	6.1554 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	1341.8 ± 0.14 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0271
Residual factor for significantly intense reflections	0.0228
Weighted residual factors for significantly intense reflections	0.0596
Weighted residual factors for all reflections included in the refinement	0.0622
Goodness-of-fit parameter for all reflections included in the refinement	1.075
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
179141 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/02.	4310273.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4310273.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4310273.cif
1761	2010-11-06	../uploads/cif-deposit/cod/cif Adding structures of 4310273 via cif-deposit CGI script.	4310273.cif