Crystallography Open Database

Information card for entry 7237724

Preview

Coordinates	7237724.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H48 Br10 N6 O9 Pb2
Calculated formula	C18 H48 Br10 N6 O9 Pb2
Title of publication	Dual phosphorescence from the organic and inorganic moieties of 1D hybrid perovskites of the Pbn′Br4n′+2 series (n′ = 2, 3, 4, 5)
Authors of publication	Ben Haj Salah, Maroua; Mercier, Nicolas; Allain, Magali; Zouari, Nabil; Botta, Chiara
Journal of publication	Journal of Materials Chemistry C
Year of publication	2019
Journal volume	7
Journal issue	15
Pages of publication	4424
a	8.1393 ± 0.0003 Å
b	25.2015 ± 0.0009 Å
c	10.9881 ± 0.0005 Å
α	90°
β	91.088 ± 0.003°
γ	90°
Cell volume	2253.5 ± 0.15 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	149.9 ± 0.3 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0684
Residual factor for significantly intense reflections	0.0576
Weighted residual factors for significantly intense reflections	0.1458
Weighted residual factors for all reflections included in the refinement	0.1516
Goodness-of-fit parameter for all reflections included in the refinement	1.013
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
238557 (current)	2019-11-24	cif/ Adding structures of 7237724, 7237725, 7237726, 7237727 via cif-deposit CGI script.	7237724.cif