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Information card for entry 4323842
Preview
Coordinates | 4323842.cif |
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Original paper (by DOI) | HTML |
Chemical name | (2,2'-Bispyridyldiselenide-N,N')bis(chloro)zinc(II) |
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Formula | C10 H8 Cl2 N2 Se2 Zn |
Calculated formula | C10 H8 Cl2 N2 Se2 Zn |
SMILES | [Se]1[Se]c2[n]([Zn](Cl)(Cl)[n]3c1cccc3)cccc2 |
Title of publication | Coordination Chemistry of 2,2'-Dipyridyl Diselenide: X-ray Crystal Structures of PySeSePy, [Zn(PySeSePddy)Cl~2~], [(PySeSePy):Hg(C~6~F~5~)~2~], [Mo(SePy)~2~(CO)~3~], [W(SePy)~2~(CO)~3~], and [Fe(SePy)~2~(CO)~2~] (PySeSePy = C~5~H~4~NSeSeC~5~H~4~N; SePy = [C~5~H~4~N(2-Se)-N,Se]) |
Authors of publication | Carsten O. Kienitz; Carsten Thöne; Peter G. Jones |
Journal of publication | Inorganic Chemistry |
Year of publication | 1996 |
Journal volume | 35 |
Pages of publication | 3990 - 3997 |
a | 7.943 ± 0.001 Å |
b | 8.147 ± 0.002 Å |
c | 11.999 ± 0.002 Å |
α | 93.685 ± 0.01° |
β | 107.763 ± 0.01° |
γ | 115.44 ± 0.01° |
Cell volume | 650.3 ± 0.2 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.055 |
Residual factor for significantly intense reflections | 0.0447 |
Weighted residual factors for all reflections | 0.1186 |
Weighted residual factors for significantly intense reflections | 0.1147 |
Goodness-of-fit parameter for all reflections | 0.978 |
Goodness-of-fit parameter for significantly intense reflections | 1.06 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4323842.html
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