Crystallography Open Database

Information card for entry 7236856

Preview

Coordinates	7236856.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	AC-8-450K
Formula	C16 H20 Br5 N2 Sb
Calculated formula	C16 H20 Br5 N2 Sb
Title of publication	Thermochromism to tune the optical bandgap of a lead-free perovskite-type hybrid semiconductor for efficiently enhancing photocurrent generation
Authors of publication	Zhang, Weichuan; Sun, Zhihua; Zhang, Jing; Han, Shiguo; Ji, Chengmin; Li, Lina; Hong, Maochun; Luo, Junhua
Journal of publication	Journal of Materials Chemistry C
Year of publication	2017
Journal volume	5
Journal issue	38
Pages of publication	9967
a	10.9137 ± 0.0005 Å
b	15.166 ± 0.0006 Å
c	13.616 ± 0.0005 Å
α	90°
β	99.598 ± 0.004°
γ	90°
Cell volume	2222.13 ± 0.16 Å³
Cell temperature	295 ± 0.1 K
Ambient diffraction temperature	295 ± 0.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0654
Residual factor for significantly intense reflections	0.0362
Weighted residual factors for significantly intense reflections	0.0553
Weighted residual factors for all reflections included in the refinement	0.0622
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
236578 (current)	2019-11-24	cif/ Adding structures of 7236855, 7236856, 7236857, 7236858, 7236859 via cif-deposit CGI script.	7236856.cif