Crystallography Open Database

Information card for entry 7237398

Preview

Coordinates	7237398.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H20 B3 F12 N3
Calculated formula	C7 H16 B3 F12 N3
Title of publication	Photoluminescence of Sn2±-I−-mixed molecular perovskites
Authors of publication	Fan, Guang-Meng; Shi, Chao; Qiao, Liang; Li, Hao-Jie; Ye, Heng-Yun
Journal of publication	Journal of Materials Chemistry C
Year of publication	2018
Journal volume	6
Journal issue	31
Pages of publication	8349
a	10.213 ± 0.002 Å
b	10.213 ± 0.002 Å
c	53.387 ± 0.009 Å
α	90°
β	90°
γ	120°
Cell volume	4822.5 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.147
Residual factor for significantly intense reflections	0.1254
Weighted residual factors for significantly intense reflections	0.3255
Weighted residual factors for all reflections included in the refinement	0.3425
Goodness-of-fit parameter for all reflections included in the refinement	1.129
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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