Crystallography Open Database

Information card for entry 2008195

2008194 << 2008195 >> 2008196

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Coordinates	2008195.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	A Binuclear Cadmium(II) complex: Bis(diisopropyldithiocarbamate) Cadmium(II)
Formula	C28 H56 Cd2 N4 S8
Calculated formula	C28 H56 Cd2 N4 S8
SMILES	CC(C)N(C(C)C)C1=[S][Cd]23([S](C(N(C(C)C)C(C)C)=[S]2)[Cd]24([S]=C(N(C(C)C)C(C)C)[S]32)[S]=C(N(C(C)C)C(C)C)S4)S1
Title of publication	A binuclear cadmium(II) complex: bis[bis(<i>N,N</i>-diisopropyldithiocarbamato)cadmium(II)]
Authors of publication	Fang-fang Jian; Zuo-xiang Wang; Hoong-Kun Fun; Zhi-ping Bai; Xiao-zeng You
Journal of publication	Acta Crystallographica Section C
Year of publication	1999
Journal volume	55
Journal issue	2
Pages of publication	174 - 176
a	11.6017 ± 0.001 Å
b	11.2268 ± 0.0011 Å
c	16.752 ± 0.0015 Å
α	90°
β	108.936 ± 0.008°
γ	90°
Cell volume	2063.9 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0586
Residual factor for significantly intense reflections	0.0411
Weighted residual factors for all reflections	0.1056
Weighted residual factors for significantly intense reflections	0.0989
Goodness-of-fit parameter for all reflections	0.95
Goodness-of-fit parameter for significantly intense reflections	1.045
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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