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Information card for entry 2203941
Preview
Coordinates | 2203941.cif |
---|---|
Structure factors | 2203941.hkl |
Original IUCr paper | HTML |
Chemical name | [1-(5-Chloro-2-oxidophenyl)ethanone 4-nitrobenzoylhydrazonato(2-)]tripyridinenickel(II) pyridine solvate |
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Formula | C35 H30 Cl N7 Ni O4 |
Calculated formula | C35 H30 Cl N7 Ni O4 |
SMILES | [Ni]12(Oc3ccc(cc3C(=[N]2N=C(O1)c1ccc(cc1)N(=O)=O)C)Cl)([n]1ccccc1)([n]1ccccc1)[n]1ccccc1.n1ccccc1 |
Title of publication | [1-(5-Chloro-2-oxidophenyl)ethanone 4-nitrobenzoylhydrazonato(2{-})]tris(pyridine)nickel(II) pyridine solvate |
Authors of publication | Hapipah, Ali; Khamis, Nur Ashikin; Basirun, W. Jefri.; Bohari, M.Yamin |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2004 |
Journal volume | 60 |
Journal issue | 7 |
Pages of publication | m912 - m914 |
a | 12.585 ± 0.002 Å |
b | 21.175 ± 0.003 Å |
c | 12.704 ± 0.002 Å |
α | 90° |
β | 90.211 ± 0.003° |
γ | 90° |
Cell volume | 3385.4 ± 0.9 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
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 | 0.091 |
Residual factor for significantly intense reflections | 0.057 |
Weighted residual factors for significantly intense reflections | 0.123 |
Weighted residual factors for all reflections included in the refinement | 0.139 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2203941.html
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