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Information card for entry 7016691
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Coordinates | 7016691.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (HNP2NiNCCH3)(BF4)2 |
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Formula | C18 H40 B2 F8 N2 Ni P2 |
Calculated formula | C18 H40 B2 F8 N2 Ni P2 |
SMILES | [Ni]12([P](C(C)C)(C(C)C)CC[NH]2CC[P]1(C(C)C)C(C)C)[N]#CC.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-] |
Title of publication | Metal complexes of Co, Ni and Cu with the pincer ligand HN(CH(2)CH(2)P(i)Pr(2))(2): preparation, characterization and electrochemistry. |
Authors of publication | Rozenel, Sergio S.; Kerr, John B.; Arnold, John |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 40 |
Pages of publication | 10397 - 10405 |
a | 15.647 Å |
b | 12.136 Å |
c | 14.337 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2722.48 Å3 |
Cell temperature | 124 ± 2 K |
Ambient diffraction temperature | 124 ± 2 K |
Number of distinct elements | 7 |
Space group number | 29 |
Hermann-Mauguin space group symbol | P c a 21 |
Hall space group symbol | P 2c -2ac |
Residual factor for all reflections | 0.029 |
Residual factor for significantly intense reflections | 0.0266 |
Weighted residual factors for significantly intense reflections | 0.0699 |
Weighted residual factors for all reflections included in the refinement | 0.0716 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7016691.html
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