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Information card for entry 7028327
Preview
Coordinates | 7028327.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H52 Ir2 P2 |
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Calculated formula | C28 H52 Ir2 P2 |
SMILES | [Ir]12345([Ir]678([P]1(C(C)C)C(C)C)([P]2(C(C)C)C(C)C)[CH]1=[CH]6CC[CH]7=[CH]8CC1)[CH]1=[CH]3CC[CH]4=[CH]5CC1 |
Title of publication | P-H activation of secondary phosphanes on a parent amido diiridium complex. |
Authors of publication | Mena, Inmaculada; Casado, Miguel A.; Polo, Víctor; García-Orduña, Pilar; Lahoz, Fernando J.; Oro, Luis A. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 4 |
Pages of publication | 1609 - 1619 |
a | 12.0438 ± 0.0006 Å |
b | 13.3654 ± 0.0006 Å |
c | 17.5773 ± 0.0008 Å |
α | 90° |
β | 95.2757 ± 0.0006° |
γ | 90° |
Cell volume | 2817.4 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0264 |
Residual factor for significantly intense reflections | 0.0173 |
Weighted residual factors for significantly intense reflections | 0.0369 |
Weighted residual factors for all reflections included in the refinement | 0.04 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
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/7028327.html
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Users of the data should acknowledge the original authors of the
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