Crystallography Open Database

Information card for entry 7056865

Preview

Coordinates	7056865.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Cu2(N3)3(Et2,Me-en)2]n(ClO4)n
Formula	C14 H36 Cl Cu2 N13 O4
Calculated formula	C14 H36 Cl Cu2 N13 O4
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	7.8921 ± 0.0009 Å
b	12.8529 ± 0.0012 Å
c	13.2899 ± 0.0014 Å
α	70.941 ± 0.013°
β	82.294 ± 0.014°
γ	82.146 ± 0.014°
Cell volume	1256.5 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0437
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.1047
Weighted residual factors for all reflections included in the refinement	0.1072
Goodness-of-fit parameter for all reflections included in the refinement	1.024
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.	7056865.cif
204969	2018-01-09	cif/ Adding structures of 7056862, 7056863, 7056864, 7056865 via cif-deposit CGI script.	7056865.cif