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Information card for entry 4081949
Preview
Coordinates | 4081949.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (CF3-PCP)Os(cod)H |
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Formula | C20 H20 F12 Os P2 |
Calculated formula | C20 H20 F12 Os P2 |
SMILES | [OsH]12345([P](Cc6c2c(ccc6)C[P]1(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F)[CH]1=[CH]3CC[CH]4=[CH]5CC1 |
Title of publication | Acceptor Pincer Chemistry of Osmium: Catalytic Alkane Dehydrogenation by (CF3PCP)Os(cod)(H) |
Authors of publication | Gruver, Brian C.; Adams, Jeramie J.; Arulsamy, Navamoney; Roddick, Dean M. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 21 |
Pages of publication | 6468 |
a | 12.2665 ± 0.0001 Å |
b | 12.9348 ± 0.0002 Å |
c | 14.289 ± 0.0001 Å |
α | 90° |
β | 93.041 ± 0.001° |
γ | 90° |
Cell volume | 2263.97 ± 0.04 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0453 |
Residual factor for significantly intense reflections | 0.032 |
Weighted residual factors for significantly intense reflections | 0.0707 |
Weighted residual factors for all reflections included in the refinement | 0.0755 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
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/4081949.html
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Users of the data should acknowledge the original authors of the
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