Crystallography Open Database

Information card for entry 7231477

Preview

Coordinates	7231477.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H22 Cl6 Cu N2
Calculated formula	C8 H22 Cl6 Cu N2
Title of publication	Switchable dielectric phase transition behaviors in two organic‒inorganic copper(ii) halides with distinct coordination geometries
Authors of publication	Mei, Ying-Xuan; Hua, Xiu-Ni; Gao, Ji-Xing; Liao, Wei-Qiang
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	40
Pages of publication	6261
a	9.1398 ± 0.0018 Å
b	11.737 ± 0.002 Å
c	19.444 ± 0.005 Å
α	90°
β	117.68 ± 0.02°
γ	90°
Cell volume	1847.1 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.1806
Residual factor for significantly intense reflections	0.0697
Weighted residual factors for significantly intense reflections	0.1338
Weighted residual factors for all reflections included in the refinement	0.1789
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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