Crystallography Open Database

Information card for entry 7226589

Preview

Coordinates	7226589.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H10 Br2 I4 N2 Pb
Calculated formula	C10 H10 Br2 I4 N2 Pb
Title of publication	Structural diversity in substituted-pyridinium iodo- and bromoplumbates: a matter of halide and temperature
Authors of publication	Gómez, Verónica; Fuhr, Olaf; Ruben, Mario
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	42
Pages of publication	8207
a	12.1436 ± 0.0014 Å
b	8.7824 ± 0.0006 Å
c	9.4776 ± 0.0011 Å
α	90°
β	99.676 ± 0.009°
γ	90°
Cell volume	996.41 ± 0.18 Å³
Cell temperature	180.15 K
Ambient diffraction temperature	180.15 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0782
Residual factor for significantly intense reflections	0.0683
Weighted residual factors for significantly intense reflections	0.1872
Weighted residual factors for all reflections included in the refinement	0.2024
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
188108 (current)	2016-11-08	cif/ Updating files of 7226587, 7226588, 7226589, 7226590, 7226591, 7226592, 7226593, 7226594, 7226595, 7226596, 7226597, 7226598, 7226599, 7226600, 7226601 Original log message: Adding full bibliography for 7226587--7226601.cif.	7226589.cif
186698	2016-09-22	cif/ Adding structures of 7226587, 7226588, 7226589, 7226590, 7226591, 7226592, 7226593, 7226594, 7226595, 7226596, 7226597, 7226598, 7226599, 7226600, 7226601 via cif-deposit CGI script.	7226589.cif