Crystallography Open Database

Information card for entry 7241764

Preview

Coordinates	7241764.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	ethylenediammonium lead iodide chloride
Formula	C16 H80 Cl8 I16 N16 Pb4
Calculated formula	C16 H80 Cl8 I16 N16 Pb4
Title of publication	Anomalous inclusion of chloride ions in ethylenediammonium lead iodide turns 1D non-perovskite into a 2D perovskite structure
Authors of publication	Fazayeli, Monireh; Khatamian, Maasoumeh; Cruciani, Giuseppe
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	46
Pages of publication	8063 - 8071
a	8.759 ± 0.0004 Å
b	9.44 ± 0.0004 Å
c	23.545 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	1946.82 ± 0.14 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
Space group number	57
Hermann-Mauguin space group symbol	P b c m
Hall space group symbol	-P 2c 2b
Residual factor for all reflections	0.1083
Residual factor for significantly intense reflections	0.0676
Weighted residual factors for significantly intense reflections	0.1527
Weighted residual factors for all reflections included in the refinement	0.1745
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7241764.html