Crystallography Open Database

Information card for entry 2311362

Preview

Coordinates	2311362.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Bis(μ-2-methylbenzenethiolato-κ^2^<i>S</i>:<i>S</i>)bis[methyl(2-methylbenzenethiolato-κ<i>S</i>)indium(III)]
Formula	C30 H34 In2 S4
Calculated formula	C30 H34 In2 S4
Title of publication	Synthesis and crystal structure of bis-(μ-2-methyl-benzene-thiol-ato-κ<sup>2</sup><i>S</i>:<i>S</i>)bis-[meth-yl(2-methyl-benzene-thiol-ato-κ<i>S</i>)indium(III)].
Authors of publication	Briand, Glen G.; Decken, Andreas; Dickie, Courtney M.; MacNeil, Gregory
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2017
Journal volume	73
Journal issue	Pt 4
Pages of publication	481 - 483
a	7.4441 ± 0.0015 Å
b	14.625 ± 0.003 Å
c	14.074 ± 0.003 Å
α	90°
β	99.693 ± 0.003°
γ	90°
Cell volume	1510.4 ± 0.5 Å³
Cell temperature	173 ± 1 K
Ambient diffraction temperature	173 ± 1 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0504
Residual factor for significantly intense reflections	0.0344
Weighted residual factors for significantly intense reflections	0.0673
Weighted residual factors for all reflections included in the refinement	0.0739
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
245826 (current)	2019-12-25	cif/ Adding structures of 2311362 via cif-deposit CGI script.	2311362.cif