Crystallography Open Database

Information card for entry 2311563

Preview

Coordinates	2311563.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	[<i>N</i>-(2-Methoxyethyl)-<i>N</i>-methyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>']triphenyltin(IV)
Formula	C23 H25 N O S2 Sn
Calculated formula	C23 H25 N O S2 Sn
SMILES	[Sn]1(SC(=[S]1)N(C)CCOC)(c1ccccc1)(c1ccccc1)c1ccccc1
Title of publication	Crystal structures and Hirshfeld surface analyses of bis-[<i>N</i>,<i>N</i>-bis-(2-meth-oxy-eth-yl)di-thio-carbamato-κ<sup>2</sup><i>S</i>,<i>S</i>']di-<i>n</i>-butyl-tin(IV) and [<i>N</i>-(2-meth-oxy-eth-yl)-<i>N</i>-methyl-dithio-carbamato-κ<sup>2</sup><i>S</i>,<i>S</i>']tri-phenyl-tin(IV).
Authors of publication	Mohamad, Rapidah; Awang, Normah; Kamaludin, Nurul Farahana; Jotani, Mukesh M.; Tiekink, Edward R. T.
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2018
Journal volume	74
Journal issue	Pt 3
Pages of publication	302 - 308
a	7.6258 ± 0.0003 Å
b	10.2178 ± 0.0003 Å
c	14.8621 ± 0.0006 Å
α	91.976 ± 0.003°
β	90.655 ± 0.003°
γ	107.875 ± 0.003°
Cell volume	1101.19 ± 0.07 Å³
Cell temperature	148 ± 2 K
Ambient diffraction temperature	148 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0427
Residual factor for significantly intense reflections	0.0397
Weighted residual factors for significantly intense reflections	0.1108
Weighted residual factors for all reflections included in the refinement	0.1138
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
245985 (current)	2019-12-25	cif/ Adding structures of 2311562, 2311563 via cif-deposit CGI script.	2311563.cif