Crystallography Open Database

Information card for entry 2311562

Preview

Coordinates	2311562.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Bis[<i>N</i>,<i>N</i>-bis(2-methoxyethyl)dithiocarbamato-κ^2^<i>S</i>,<i>S</i>']di-<i>n</i>-butyltin(IV)
Formula	C22 H46 N2 O4 S4 Sn
Calculated formula	C22 H46 N2 O4 S4 Sn
SMILES	C(=S)(N(CCOC)CCOC)S[Sn](SC(=S)N(CCOC)CCOC)(CCCC)CCCC
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	25.8819 ± 0.0017 Å
b	7.1272 ± 0.0004 Å
c	16.4146 ± 0.0011 Å
α	90°
β	97.282 ± 0.006°
γ	90°
Cell volume	3003.5 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
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	0.0665
Residual factor for significantly intense reflections	0.0483
Weighted residual factors for significantly intense reflections	0.1143
Weighted residual factors for all reflections included in the refinement	0.1282
Goodness-of-fit parameter for all reflections included in the refinement	1.046
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.	2311562.cif