Crystallography Open Database

Information card for entry 2242185

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Structure parameters

Chemical name	Bis(tetramethylammonium) tetrachloridocuprate(II)
Formula	C8 H24 Cl4 Cu N2
Calculated formula	C8 H24 Cl4 Cu N2
SMILES	[Cu](Cl)(Cl)([Cl-])[Cl-].[N+](C)(C)(C)C.[N+](C)(C)(C)C
Title of publication	Crystal structure of the monoclinic phase (phase IV) of bis(tetramethylammonium) tetrachloridocuprate(II)
Authors of publication	Seck, Gorgui Awa; Diop, Libasse; Oliver, Allen G.
Journal of publication	Acta Crystallographica Section E
Year of publication	2017
Journal volume	73
Journal issue	3
Pages of publication	358 - 360
a	8.9901 ± 0.0005 Å
b	12.0059 ± 0.0007 Å
c	14.957 ± 0.0009 Å
α	90°
β	91.719 ± 0.003°
γ	90°
Cell volume	1613.65 ± 0.16 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0988
Residual factor for significantly intense reflections	0.0657
Weighted residual factors for significantly intense reflections	0.1309
Weighted residual factors for all reflections included in the refinement	0.1408
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	Yes

Version history

Revision	Date	Message	Files
199155 (current)	2017-07-25	cif/ hkl/ Adding structures of 2242185 via cif-deposit CGI script.	2242185.cif 2242185.hkl