Crystallography Open Database

Information card for entry 7710079

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Coordinates	7710079.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H56 Cd2 Cl8 N4
Calculated formula	C36 H56 Cd2 Cl8 N4
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	7.7817 ± 0.0001 Å
b	7.7972 ± 0.0001 Å
c	18.2458 ± 0.0003 Å
α	94.151 ± 0.001°
β	97.976 ± 0.001°
γ	90.842 ± 0.001°
Cell volume	1093.14 ± 0.03 Å³
Cell temperature	360 K
Ambient diffraction temperature	360 K
Number of distinct elements	5
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.0425
Residual factor for significantly intense reflections	0.0329
Weighted residual factors for significantly intense reflections	0.0794
Weighted residual factors for all reflections included in the refinement	0.0838
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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