Crystallography Open Database

Information card for entry 7237234

Preview

Coordinates	7237234.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H8 Bi3 I10 N
Calculated formula	C6 H8 Bi3 I10 N
Title of publication	Polymeric iodobismuthates {[Bi3I10]} and {[BiI4]} with N-heterocyclic cations: promising perovskite-like photoactive materials for electronic devices
Authors of publication	Usoltsev, Andrey N.; Elshobaki, Moneim; Adonin, Sergey A.; Frolova, Lyubov A.; Derzhavskaya, Tatiyana; Abramov, Pavel A.; Anokhin, Denis V.; Korolkov, Ilya V.; Luchkin, Sergey Yu.; Dremova, Nadezhda N.; Stevenson, Keith J.; Sokolov, Maxim N.; Fedin, Vladimir P.; Troshin, Pavel A.
Journal of publication	Journal of Materials Chemistry A
Year of publication	2019
Journal volume	7
Journal issue	11
Pages of publication	5957
a	10.8976 ± 0.0003 Å
b	11.2977 ± 0.0003 Å
c	23.3163 ± 0.0007 Å
α	90°
β	98.257 ± 0.003°
γ	90°
Cell volume	2840.89 ± 0.14 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0559
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for significantly intense reflections	0.1248
Weighted residual factors for all reflections included in the refinement	0.1274
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
237508 (current)	2019-11-24	cif/ Adding structures of 7237234, 7237235, 7237236, 7237237, 7237238, 7237239 via cif-deposit CGI script.	7237234.cif