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Information card for entry 4063978
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Coordinates | 4063978.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Pt(dippe)(o-C6H4CN)(CN) |
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Formula | C29 H43 N3 O P2 Pt |
Calculated formula | C29 H43 N3 O P2 Pt |
SMILES | [Pt]1([P](CC[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)(c1c(cccc1)C#N)C#N.O=C(N)c1ccccc1 |
Title of publication | C−CN vs C−H Cleavage of Benzonitrile Using [(dippe)PtH]2 |
Authors of publication | Swartz, Brett D.; Brennessel, William W.; Jones, William D. |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 6 |
Pages of publication | 1523 |
a | 9.1413 ± 0.0016 Å |
b | 20.435 ± 0.004 Å |
c | 16.351 ± 0.003 Å |
α | 90° |
β | 95.311 ± 0.003° |
γ | 90° |
Cell volume | 3041.3 ± 1 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 6 |
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 | 0.0861 |
Residual factor for significantly intense reflections | 0.0533 |
Weighted residual factors for significantly intense reflections | 0.1237 |
Weighted residual factors for all reflections included in the refinement | 0.1386 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
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/4063978.html
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