Crystallography Open Database

Information card for entry 7026168

Preview

Coordinates	7026168.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H26 Cu2 N6
Calculated formula	C18 H26 Cu2 N6
Title of publication	Cracking the framework of bulk CuCN with flexible bipyrazolyl-based ligands to assemble [CuCN]n-based coordination polymers.
Authors of publication	Li, Ling-Ling; Liu, Lei-Lei; Zheng, Ai-Xia; Chang, Yu-Jie; Dai, Ming; Ren, Zhi-Gang; Li, Hong-Xi; Lang, Jian-Ping
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	33
Pages of publication	7659 - 7665
a	8.6907 ± 0.0017 Å
b	8.8881 ± 0.0018 Å
c	14.374 ± 0.003 Å
α	90.43 ± 0.03°
β	91.41 ± 0.03°
γ	109.99 ± 0.03°
Cell volume	1042.9 ± 0.4 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0769
Residual factor for significantly intense reflections	0.0574
Weighted residual factors for significantly intense reflections	0.1661
Weighted residual factors for all reflections included in the refinement	0.1754
Goodness-of-fit parameter for all reflections included in the refinement	1.089
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
179967 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/61.	7026168.cif
93425	2014-01-13	cif/ Adding structures of 7026163, 7026164, 7026165, 7026166, 7026167, 7026168 via cif-deposit CGI script.	7026168.cif