Crystallography Open Database

Information card for entry 4501503

Preview

Coordinates	4501503.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H12 Cu2 N6 S2
Calculated formula	C17 H12 Cu2 N6 S2
Title of publication	Formation of [CuSCN]n-Based Topological Structures via a Family of Flexible Benzimidazolyl-Based Linkers with Different Spacer Lengths
Authors of publication	Li, Ling-Ling; Yuan, Rong-Xin; Liu, Lei-Lei; Ren, Zhi-Gang; Zheng, Ai-Xia; Cheng, Hong-Jian; Li, Hong-Xi; Lang, Jian-Ping
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	4
Pages of publication	1929
a	18.113 ± 0.004 Å
b	5.6189 ± 0.0011 Å
c	18.304 ± 0.004 Å
α	90°
β	107.29 ± 0.03°
γ	90°
Cell volume	1778.7 ± 0.7 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0508
Residual factor for significantly intense reflections	0.0356
Weighted residual factors for significantly intense reflections	0.0799
Weighted residual factors for all reflections included in the refinement	0.0856
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
179546 (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 4/50/15.	4501503.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501503.cif
35951	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4501503, 4501504, 4501505, 4501506, 4501507, 4501508, 4501509 via cif-deposit CGI script.	4501503.cif