Crystallography Open Database

Information card for entry 4316210

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Coordinates	4316210.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H10 Cd F10 N2 Se2
Calculated formula	C22 H10 Cd F10 N2 Se2
SMILES	[Cd]([Se]c1c(F)c(F)c(F)c(F)c1F)([Se]c1c(F)c(F)c(F)c(F)c1F)([n]1ccccc1)[n]1ccccc1
Title of publication	Zinc, Cadmium, and Mercury Complexes with Fluorinated Selenolate Ligands
Authors of publication	Thomas J. Emge; Michael D. Romanelli; Brian F. Moore; John G. Brennan
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	7304 - 7312
a	9.086 ± 0.003 Å
b	23.255 ± 0.007 Å
c	12.034 ± 0.004 Å
α	90°
β	109.276 ± 0.006°
γ	90°
Cell volume	2400.2 ± 1.3 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0715
Residual factor for significantly intense reflections	0.0438
Weighted residual factors for significantly intense reflections	0.0842
Weighted residual factors for all reflections included in the refinement	0.0914
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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