Crystallography Open Database

Information card for entry 7236651

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Coordinates	7236651.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H6 I3 N Pb
Calculated formula	I3 N Pb
Title of publication	Gas induced conversion of hybrid perovskite single crystal to single crystal for great enhancement of their photoelectric properties
Authors of publication	Ju, Dianxing; Zhao, Tianyu; Yangyang, Dang; Zhang, Guodong; Hu, Xiaobo; Cui, Deliang; Tao, Xutang
Journal of publication	Journal of Materials Chemistry A
Year of publication	2017
Journal volume	5
Journal issue	41
Pages of publication	21919
a	6.3026 ± 0.0013 Å
b	6.3026 ± 0.0013 Å
c	6.3026 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	250.36 ± 0.09 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	221
Hermann-Mauguin space group symbol	P m -3 m
Hall space group symbol	-P 4 2 3
Residual factor for all reflections	0.0387
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.1208
Weighted residual factors for all reflections included in the refinement	0.1208
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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