Crystallography Open Database

Information card for entry 1545320

Preview

Coordinates	1545320.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H6 Br3 N Pb
Calculated formula	C0.9984 H5.9904 Br3 N0.9984 Pb
Title of publication	Unbalanced Hole and Electron Diffusion in Lead Bromide Perovskites.
Authors of publication	Elbaz, Giselle A.; Straus, Daniel B.; Semonin, Octavi E.; Hull, Trevor D.; Paley, Daniel W.; Kim, Philip; Owen, Jonathan S.; Kagan, Cherie R.; Roy, Xavier
Journal of publication	Nano letters
Year of publication	2017
Journal volume	17
Journal issue	3
Pages of publication	1727 - 1732
a	5.9195 ± 0.0001 Å
b	5.9195 ± 0.0001 Å
c	5.9195 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	207.422 ± 0.006 Å³
Cell temperature	293.92 ± 0.1 K
Ambient diffraction temperature	294 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	0.029
Residual factor for significantly intense reflections	0.0286
Weighted residual factors for significantly intense reflections	0.0669
Weighted residual factors for all reflections included in the refinement	0.0669
Goodness-of-fit parameter for all reflections included in the refinement	1.22
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
194863 (current)	2017-04-04	cif/ Updating files of 1545319, 1545320 Original log message: Adding full bibliography for 1545319--1545320.cif.	1545320.cif
192663	2017-03-02	cif/ Adding structures of 1545320 via cif-deposit CGI script.	1545320.cif