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Information card for entry 4075430
Preview
Coordinates | 4075430.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H35 N P2 Ti |
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Calculated formula | C22 H35 N P2 Ti |
SMILES | [Ti]123456789%10%11([P]%12(N2C(C)(C)C)[C]3(=[P]1C4%12C(C)(C)C)C(C)(C)C)[CH]1=[CH]5[CH]6=[CH]7[CH]8=[CH]9[CH]%10=[CH]%111 |
Title of publication | Reactions oftBuC⋮P with Cyclooctatetraene-Supported Titanium Imido Complexes |
Authors of publication | Cloke, F. Geoffrey N.; Green, Jennifer C.; Hazari, Nilay; Hitchcock, Peter B.; Mountford, Philip; Nixon, John F.; Wilson, D. James |
Journal of publication | Organometallics |
Year of publication | 2006 |
Journal volume | 25 |
Journal issue | 15 |
Pages of publication | 3688 |
a | 14.054 ± 0.006 Å |
b | 10.19 ± 0.004 Å |
c | 15.592 ± 0.002 Å |
α | 90° |
β | 93.9 ± 0.03° |
γ | 90° |
Cell volume | 2227.8 ± 1.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0591 |
Residual factor for significantly intense reflections | 0.0401 |
Weighted residual factors for all reflections | 0.099 |
Weighted residual factors for significantly intense reflections | 0.0892 |
Goodness-of-fit parameter for all reflections | 1.016 |
Goodness-of-fit parameter for significantly intense reflections | 1.043 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4075430.html
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