Crystallography Open Database

Information card for entry 2242291

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Structure parameters

Chemical name	Bis(μ-<i>N</i>,<i>N</i>-diallyldithiocarbamato)bis[(<i>N</i>,<i>N</i>-diallyldithiocarbamato)cadmium]
Formula	C28 H40 Cd2 N4 S8
Calculated formula	C28 H40 Cd2 N4 S8
SMILES	[Cd]123([S]=C([S]1[Cd]14([S]=C([S]21)N(CC=C)CC=C)[S]=C(S4)N(CC=C)CC=C)N(CC=C)CC=C)[S]=C(S3)N(CC=C)CC=C
Title of publication	Bis(μ-<i>N</i>,<i>N</i>-diallyldithiocarbamato)bis[(<i>N</i>,<i>N</i>-diallyldithiocarbamato)cadmium]
Authors of publication	Onwudiwe, Damian C.; Hrubaru, Madalina; Hosten, Eric C.; Arderne, Charmaine
Journal of publication	Acta Crystallographica Section E
Year of publication	2017
Journal volume	73
Journal issue	9
Pages of publication	1353 - 1356
a	8.0872 ± 0.0002 Å
b	9.4146 ± 0.0002 Å
c	13.0721 ± 0.0003 Å
α	75.858 ± 0.001°
β	78.46 ± 0.001°
γ	77.488 ± 0.001°
Cell volume	930.75 ± 0.04 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0168
Residual factor for significantly intense reflections	0.015
Weighted residual factors for significantly intense reflections	0.0356
Weighted residual factors for all reflections included in the refinement	0.0371
Goodness-of-fit parameter for all reflections included in the refinement	1.152
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
199900 (current)	2017-08-23	cif/ hkl/ Adding structures of 2242291 via cif-deposit CGI script.	2242291.cif 2242291.hkl