Crystallography Open Database

Information card for entry 2238681

Preview

Coordinates	2238681.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Dichloridodiphenylbis(thiourea-κ<i>S</i>)tin(IV)
Formula	C14 H18 Cl2 N4 S2 Sn
Calculated formula	C14 H18 Cl2 N4 S2 Sn
SMILES	[S](=C(N)N)[Sn](c1ccccc1)(Cl)(Cl)([S]=C(N)N)c1ccccc1
Title of publication	Dichloridodiphenylbis(thiourea-κ<i>S</i>)tin(IV)
Authors of publication	Sow, Yaya; Diop, Libasse; Molloy, Kieran C.; Kociok-Köhn, Gabriele
Journal of publication	Acta Crystallographica Section E
Year of publication	2013
Journal volume	69
Journal issue	10
Pages of publication	m539 - m540
a	14.6401 ± 0.0002 Å
b	14.6401 ± 0.0002 Å
c	17.7899 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3812.95 ± 0.1 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0259
Residual factor for significantly intense reflections	0.0193
Weighted residual factors for significantly intense reflections	0.0476
Weighted residual factors for all reflections included in the refinement	0.0513
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
176798 (current)	2016-02-21	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23.	2238681.cif
89637	2013-11-06	cif/ Adding structures of 2238681 via cif-deposit CGI script.	2238681.cif