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Information card for entry 7011120
Preview
Coordinates | 7011120.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H21 B F4 N4 Na2 Ni O6 |
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Calculated formula | C15 H21 B F4 N4 Na2 Ni O6 |
SMILES | [Ni]12345[N](CCN(CC[N]2=C(C(O3)=O)C)CC[N]4=C(C(O5)=O)C)=C(C(O1)=O)C.[Na+].[Na+].[B](F)(F)(F)[F-] |
Title of publication | Na±Mediated aggregation of imino-carboxylate transition metal complexes |
Authors of publication | Dan M. J. Doble; Alexander J. Blake; Wan-Sheung Li; Martin Schröder |
Journal of publication | J. Chem. Soc., Dalton Trans. |
Year of publication | 2001 |
Journal issue | 21 |
Pages of publication | 3137 - 3139 |
a | 9.369 ± 0.003 Å |
b | 9.369 ± 0.003 Å |
c | 28.603 ± 0.006 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 2174.3 ± 1.1 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 8 |
Space group number | 159 |
Hermann-Mauguin space group symbol | P 3 1 c |
Hall space group symbol | P 3 -2c |
Residual factor for all reflections | 0.0801 |
Residual factor for significantly intense reflections | 0.0694 |
Weighted residual factors for significantly intense reflections | 0.1749 |
Weighted residual factors for all reflections included in the refinement | 0.1885 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7011120.html
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