Crystallography Open Database

Information card for entry 4135405

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Coordinates	4135405.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H13 F N O4 Re
Calculated formula	C7 H13 F N O4 Re
Title of publication	Organic Ferroelectric Vortex-Antivortex Domain Structure.
Authors of publication	Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
Journal volume	142
Journal issue	52
Pages of publication	21932 - 21937
a	6.2249 ± 0.0002 Å
b	8.8294 ± 0.0002 Å
c	9.3691 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	514.95 ± 0.02 Å³
Cell temperature	403 ± 2 K
Ambient diffraction temperature	403 ± 2 K
Number of distinct elements	6
Space group number	38
Hermann-Mauguin space group symbol	A m m 2
Hall space group symbol	A 2 -2
Residual factor for all reflections	0.0179
Residual factor for significantly intense reflections	0.0168
Weighted residual factors for significantly intense reflections	0.0341
Weighted residual factors for all reflections included in the refinement	0.0346
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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