Crystallography Open Database

Information card for entry 1570729

Preview

Coordinates	1570729.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-[bis(2-(4-chlorophenyl)ethan-1-aminium) bis(m-iodo)-bis(iodo)-germanium(ii)]'
Formula	C16 H22 Cl2 Ge I4 N2
Calculated formula	C16 H22 Cl2 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	11.9349 ± 0.0011 Å
b	6.0242 ± 0.0006 Å
c	34.381 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2471.9 ± 0.4 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0739
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.0667
Weighted residual factors for all reflections included in the refinement	0.0767
Goodness-of-fit parameter for all reflections included in the refinement	1.005
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
288964 (current)	2024-01-09	cif/ Adding structures of 1570729 via cif-deposit CGI script.	1570729.cif