Crystallography Open Database

Information card for entry 1570731

Preview

Coordinates	1570731.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-[bis(2-(4-fluorophenyl)ethan-1-aminium) bis(m-iodo)-bis(iodo)-germanium(ii)]
Formula	C16 H22 F2 Ge I4 N2
Calculated formula	C16 H22 F2 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	11.971 ± 0.003 Å
b	11.987 ± 0.003 Å
c	16.761 ± 0.005 Å
α	79.689 ± 0.009°
β	84.394 ± 0.009°
γ	89.99 ± 0.008°
Cell volume	2354.6 ± 1.1 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0877
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.0764
Weighted residual factors for all reflections included in the refinement	0.0882
Goodness-of-fit parameter for all reflections included in the refinement	0.999
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
288966 (current)	2024-01-09	cif/ Adding structures of 1570731 via cif-deposit CGI script.	1570731.cif