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Information card for entry 2234434
Preview
Coordinates | 2234434.cif |
---|---|
Structure factors | 2234434.hkl |
Original IUCr paper | HTML |
Chemical name | Triethylammonium (indane-1,2,3-trione 1,2-dioximato-κ^2^<i>N</i>^1^,<i>O</i>^2^)(indane-1,2,3-trione 2-oximato 1-oxime-κ^2^<i>N</i>^1^,<i>O</i>^2^)nickel(II) |
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Formula | C24 H25 N5 Ni O6 |
Calculated formula | C24 H25 N5 Ni O6 |
SMILES | [Ni]12(N(=O)=C3C(=NO1)C(=O)c1c3cccc1)[N](O)=C1C(=NO2)C(=O)c2c1cccc2.[NH+](CC)(CC)CC |
Title of publication | Triethylammonium (indane-1,2,3-trione 1,2-dioximato-κ^2^<i>N</i>^1^,<i>O</i>^2^)(indane-1,2,3-trione 2-oximato 1-oxime-κ^2^<i>N</i>^1^,<i>O</i>^2^)nickel(II) |
Authors of publication | Zhong, Baoyun; Li, Shengli; Chen, Guifang |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 4 |
Pages of publication | m421 |
a | 9.71 ± 0.005 Å |
b | 10.47 ± 0.005 Å |
c | 12.156 ± 0.006 Å |
α | 80.785 ± 0.006° |
β | 87.639 ± 0.006° |
γ | 72.217 ± 0.006° |
Cell volume | 1161.6 ± 1 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0748 |
Residual factor for significantly intense reflections | 0.0441 |
Weighted residual factors for significantly intense reflections | 0.0684 |
Weighted residual factors for all reflections included in the refinement | 0.075 |
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 Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2234434.html
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