Crystallography Open Database

Information card for entry 7056864

Preview

Coordinates	7056864.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Cu(ambza)(N3)2]n
Formula	C7 H10 Cu N8
Calculated formula	C7 H10 Cu N8
Title of publication	Structure, magnetic properties and DFT calculations of azido-copper(ii) complexes with different azido-bonding, nuclearity and dimensionality
Authors of publication	Massoud, Salah S.; Henary, Maher M.; Maxwell, Lindley; Martín, Alejandro; Ruiz, Eliseo; Vicente, Ramon; Fischer, Roland C.; Mautner, Franz A.
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	4
Pages of publication	2627
a	12.326 ± 0.0014 Å
b	6.81 ± 0.001 Å
c	13.466 ± 0.0016 Å
α	90°
β	117.036 ± 0.003°
γ	90°
Cell volume	1006.8 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.056
Residual factor for significantly intense reflections	0.0457
Weighted residual factors for significantly intense reflections	0.0992
Weighted residual factors for all reflections included in the refinement	0.1034
Goodness-of-fit parameter for all reflections included in the refinement	1.117
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
230281 (current)	2019-11-17	cif/ Updating files of 7056862, 7056863, 7056864, 7056865 Original log message: Adding full bibliography for 7056862--7056865.cif.	7056864.cif
204969	2018-01-09	cif/ Adding structures of 7056862, 7056863, 7056864, 7056865 via cif-deposit CGI script.	7056864.cif