Crystallography Open Database

Information card for entry 4134280

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Coordinates	4134280.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H120 F24 I26 N12 Pb7
Calculated formula	C60 H120 F24 I26 N12 Pb7
Title of publication	Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric.
Authors of publication	Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	25.1842 ± 0.0005 Å
b	8.738 ± 0.0002 Å
c	32.9196 ± 0.0007 Å
α	90°
β	110.546 ± 0.002°
γ	90°
Cell volume	6783.5 ± 0.3 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 ± 2 K
Number of distinct elements	6
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.1165
Residual factor for significantly intense reflections	0.0936
Weighted residual factors for significantly intense reflections	0.2644
Weighted residual factors for all reflections included in the refinement	0.2828
Goodness-of-fit parameter for all reflections included in the refinement	1.107
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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