Crystallography Open Database

Information card for entry 8107425

Preview

Coordinates	8107425.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H58 Cl6 O2 Sn6
Calculated formula	C54 H58 Cl6 O2 Sn6
Title of publication	The crystal structure of the cocrystal di-μ 2-chlorido-tetramethyl-tetraphenyl-di-μ 3-oxido-dichloridotetratin(IV) – diphenyl-methyl-chloridotin(IV)(1/2), C54H58Cl6O2Sn6
Authors of publication	Xiao, Beibei; Xiang, Niping; Yu, Jiangxi; Wang, Chengyong; Liu, Bang
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2023
Journal volume	238
Journal issue	2
Pages of publication	309 - 311
a	9.5793 ± 0.0013 Å
b	26.161 ± 0.004 Å
c	13.1326 ± 0.0018 Å
α	90°
β	109.124 ± 0.002°
γ	90°
Cell volume	3109.5 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
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	0.0423
Residual factor for significantly intense reflections	0.0337
Weighted residual factors for significantly intense reflections	0.0729
Weighted residual factors for all reflections included in the refinement	0.0763
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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
284750 (current)	2023-07-03	cif/ Adding structures of 8107425 via cif-deposit CGI script.	8107425.cif