Crystallography Open Database

Information card for entry 7248827

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Coordinates	7248827.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H39 Cd2 Cl10 N3
Calculated formula	C21 H39 Cd2 Cl10 N3
Title of publication	Homochiral Hybrid Hexagonal Antiperovskite Crystals [R and S-3-chloroquinuclidinium]3(CdCl3)(CdCl4)
Authors of publication	Xu, Zhe-Kun; Zhang, Jia-Mei; Wang, Zhong-Xia
Journal of publication	CrystEngComm
Year of publication	2024
a	16.7102 ± 0.0001 Å
b	16.7102 ± 0.0001 Å
c	6.8101 ± 0.0001 Å
α	90°
β	90°
γ	120°
Cell volume	1646.82 ± 0.03 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	173
Hermann-Mauguin space group symbol	P 63
Hall space group symbol	P 6c
Residual factor for all reflections	0.1148
Residual factor for significantly intense reflections	0.1135
Weighted residual factors for significantly intense reflections	0.2707
Weighted residual factors for all reflections included in the refinement	0.2733
Goodness-of-fit parameter for all reflections included in the refinement	1.191
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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