Crystallography Open Database

Information card for entry 2243382

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Structure parameters

Chemical name	Di-μ-chlorido-bis{chlorido[methyl(pyridin-2-ylmethylidene)amine-κ^2^<i>N</i>,<i>N</i>']copper(II)}
Formula	C14 H16 Cl4 Cu2 N4
Calculated formula	C14 H16 Cl4 Cu2 N4
SMILES	[n]12[Cu]3([Cl][Cu]4([n]5c(cccc5)C=[N]4C)([Cl]3)Cl)(Cl)[N](=Cc1cccc2)C
Title of publication	Crystal structure and characterization of a new copper(II) chloride dimer with methyl(pyridin-2-ylmethylidene)amine
Authors of publication	Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Melnyk, Andrii K.; Skelton, Brian W.
Journal of publication	Acta Crystallographica Section E
Year of publication	2020
Journal volume	76
Journal issue	6
Pages of publication	790 - 793
a	7.7054 ± 0.0005 Å
b	7.724 ± 0.0005 Å
c	8.5606 ± 0.0005 Å
α	103.659 ± 0.005°
β	98.803 ± 0.005°
γ	110.273 ± 0.005°
Cell volume	448.74 ± 0.06 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0241
Residual factor for significantly intense reflections	0.0207
Weighted residual factors for significantly intense reflections	0.0526
Weighted residual factors for all reflections included in the refinement	0.054
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
251806 (current)	2020-05-06	cif/ hkl/ Adding structures of 2243382 via cif-deposit CGI script.	2243382.cif 2243382.hkl