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Information card for entry 2220656
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Coordinates | 2220656.cif |
---|---|
Structure factors | 2220656.hkl |
Original IUCr paper | HTML |
Common name | NiAZOnaphtholate |
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Chemical name | <i>cis</i>-Bis{1-[(4-nitrophenyl)diazenyl]-2-naphtholato}dipyridinenickel(II) |
Formula | C42 H30 N8 Ni O6 |
Calculated formula | C42 H30 N8 Ni O6 |
SMILES | [Ni]12([N](=Nc3c(ccc4ccccc34)O1)c1ccc(N(=O)=O)cc1)([N](=Nc1c(ccc3ccccc13)O2)c1ccc(N(=O)=O)cc1)([n]1ccccc1)[n]1ccccc1 |
Title of publication | <i>cis</i>-Bis{1-[(4-nitrophenyl)diazenyl]-2-naphtholato}dipyridinenickel(II) |
Authors of publication | Visentin, Lorenzo do Canto; Filgueiras, Carlos Alberto Lombardi; Bordinhão, Jairo; Ferreira, Leonardo da Cunha |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 1 |
Pages of publication | m20 - m21 |
a | 11.719 ± 0.002 Å |
b | 18.885 ± 0.004 Å |
c | 16.922 ± 0.003 Å |
α | 90° |
β | 93.04 ± 0.03° |
γ | 90° |
Cell volume | 3739.8 ± 1.2 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0651 |
Residual factor for significantly intense reflections | 0.0387 |
Weighted residual factors for significantly intense reflections | 0.0806 |
Weighted residual factors for all reflections included in the refinement | 0.0897 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
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/2220656.html
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Users of the data should acknowledge the original authors of the
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