Crystallography Open Database

Information card for entry 7206654

7206653 << 7206654 >> 7206655

Preview

Coordinates	7206654.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H63 Cu6 N15
Calculated formula	C78 H63 Cu6 N15
Title of publication	Controlling interpenetration in CuCN coordination polymers by size of the pendant substituents of terpyridine ligands
Authors of publication	Li, Xin-Zhi; Zhou, Xiao-Ping; Li, Dan; Yin, Ye-Gao
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	22
Pages of publication	6759
a	23.568 ± 0.003 Å
b	14.2616 ± 0.0016 Å
c	24.342 ± 0.004 Å
α	90°
β	118.922 ± 0.002°
γ	90°
Cell volume	7161.3 ± 1.7 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1133
Residual factor for significantly intense reflections	0.0604
Weighted residual factors for significantly intense reflections	0.1462
Weighted residual factors for all reflections included in the refinement	0.1886
Goodness-of-fit parameter for all reflections included in the refinement	1.001
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
180397 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/66.	7206654.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206654.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206654.cif
29972	2011-11-09	../uploads/cif-deposit/cod/cif Adding structures of 7206652, 7206653, 7206654, 7206655 via cif-deposit CGI script.	7206654.cif