Crystallography Open Database

Information card for entry 4328457

Preview

Coordinates	4328457.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-(1,4,8,11-Tetrathiacyclotetradecane)trichlorogallium(III)
Formula	C10 H20 Cl3 Ga S4
Calculated formula	C10 H20 Cl3 Ga S4
Title of publication	Unexpected Reactivity and Coordination in Gallium(III) and Indium(III) Chloride Complexes With Geometrically Constrained Thio- and Selenoether Ligands
Authors of publication	Kathryn George; Marek Jura; William Levason; Mark E. Light; Luke P. Ollivere; Gillian Reid
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	2231 - 2240
a	21.781 ± 0.004 Å
b	6.537 ± 0.001 Å
c	12.307 ± 0.002 Å
α	90°
β	108.56 ± 0.01°
γ	90°
Cell volume	1661.2 ± 0.5 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0213
Residual factor for significantly intense reflections	0.0193
Weighted residual factors for significantly intense reflections	0.0413
Weighted residual factors for all reflections included in the refinement	0.0424
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
179387 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/84.	4328457.cif
77423	2013-03-26	cif/ Adding structures of 4328457 via cif-deposit CGI script.	4328457.cif