Crystallography Open Database

Information card for entry 7710077

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Coordinates	7710077.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H28 Cd Cl4 N2
Calculated formula	C18 H28 Cd Cl4 N2
Title of publication	Unusual symmetry breaking in high-temperature enantiomeric ferroelectrics with large spontaneous polarization
Authors of publication	Li, Yu-Kong; Ying, Ting-Ting; Zhang, Hao; Tan, Yu-Hui; Tang, Yun-Zhi; Wang, Fang-Xin; Wan, Ming-Yang
Journal of publication	Dalton Transactions
Year of publication	2022
a	35.9424 ± 0.0011 Å
b	5.5098 ± 0.0002 Å
c	5.4475 ± 0.0002 Å
α	90°
β	94 ± 0.003°
γ	90°
Cell volume	1076.17 ± 0.06 Å³
Cell temperature	298.98 ± 0.12 K
Ambient diffraction temperature	298.98 ± 0.12 K
Number of distinct elements	5
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0225
Residual factor for significantly intense reflections	0.0224
Weighted residual factors for significantly intense reflections	0.054
Weighted residual factors for all reflections included in the refinement	0.054
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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