Crystallography Open Database

Information card for entry 1570735

Preview

Coordinates	1570735.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	4-(ammoniomethyl)pyridin-1-ium triiodo-germanium(ii) iodide
Formula	C6 H10 Ge I4 N2
Calculated formula	C6 H10 Ge I4 N2
Title of publication	Homomeric Chains of intermolecular bonds scaffold octahedral germanium perovskites
Authors of publication	Morteza Najarian, Amin; Dinic, Filip; Chen, Hao; Sabatini, Randy; Zheng, Chao; Lough, Alan J.; Maris, Thierry; Saidaminov, Makhsud I.; Garcia de Arquer, F. Pelayo; Voznyy, Oleksandr; Hoogland, Sjoerd; Sargent, Edward H.
Journal of publication	Nature
Year of publication	2023
Journal volume	620
Pages of publication	328 - 335
a	17.9943 ± 0.0012 Å
b	10.2787 ± 0.0008 Å
c	8.054 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	1489.65 ± 0.19 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.1367
Residual factor for significantly intense reflections	0.0974
Weighted residual factors for significantly intense reflections	0.2609
Weighted residual factors for all reflections included in the refinement	0.2835
Goodness-of-fit parameter for all reflections included in the refinement	1.153
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
288970 (current)	2024-01-09	cif/ Adding structures of 1570735 via cif-deposit CGI script.	1570735.cif