Crystallography Open Database

Information card for entry 4134565

Preview

Coordinates	4134565.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H10 I6 N2 Pb2
Calculated formula	C6 H10 I6 N2 Pb2
Title of publication	Three-dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse.
Authors of publication	Li, Xiaotong; He, Yihui; Kepenekian, Mikaël; Guo, Peijun; Ke, Weijun; Even, Jacky; Katan, Claudine; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G.
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	16.3698 ± 0.0012 Å
b	25.6376 ± 0.0016 Å
c	10.0435 ± 0.0006 Å
α	90°
β	93.198 ± 0.006°
γ	90°
Cell volume	4208.5 ± 0.5 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	8
Hermann-Mauguin space group symbol	I 1 m 1
Hall space group symbol	I -2y
Residual factor for all reflections	0.0598
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.0595
Weighted residual factors for all reflections included in the refinement	0.0598
Goodness-of-fit parameter for significantly intense reflections	3.53
Goodness-of-fit parameter for all reflections included in the refinement	3.35
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
249755 (current)	2020-03-27	cif/ Adding structures of 4134565 via cif-deposit CGI script.	4134565.cif