Crystallography Open Database

Information card for entry 1520053

1520052 << 1520053 >> 1520054

Preview

Coordinates	1520053.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H24 I8 N2 O2 Pb3 S2
Calculated formula	C6 I8 N2 O2 Pb3 S2
Title of publication	Solvent engineering towards controlled grain growth in perovskite planar heterojunction solar cells.
Authors of publication	Rong, Yaoguang; Tang, Zhongjia; Zhao, Yufeng; Zhong, Xin; Venkatesan, Swaminathan; Graham, Harrison; Patton, Matthew; Jing, Yan; Guloy, Arnold M.; Yao, Yan
Journal of publication	Nanoscale
Year of publication	2015
Journal volume	7
Journal issue	24
Pages of publication	10595 - 10599
a	4.6212 ± 0.0013 Å
b	27.484 ± 0.008 Å
c	26.923 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	3419.5 ± 1.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.1237
Residual factor for significantly intense reflections	0.0538
Weighted residual factors for significantly intense reflections	0.1053
Weighted residual factors for all reflections included in the refinement	0.1217
Goodness-of-fit parameter for all reflections included in the refinement	0.836
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1520053.cif
143719	2015-07-11	cif/ Updating files of 1520053 Original log message: Adding full bibliography for 1520053.cif.	1520053.cif
137469	2015-05-28	cif/ Adding structures of 1520053 via cif-deposit CGI script.	1520053.cif