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Information card for entry 4070449
Preview
Coordinates | 4070449.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C43 H43 N2 O2 P Ru |
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Calculated formula | C43 H43 N2 O2 P Ru |
SMILES | C(#[O])[Ru]12(C#[O])(=C3N(C=CN3CC[CH]1=[CH2]2)c1c(cc(cc1C)C)C)[P](c1ccccc1)(c1ccccc1)c1ccccc1.c1(ccccc1)C |
Title of publication | Chelation-Assisted Reactions of Phosphine- and Olefin-Tethered Imidazolium Derivatives and Their Affiliated N-Heterocyclic Carbenes with Roper’s Complex Ru(CO)2(PPh3)3 |
Authors of publication | Benhamou, Laure; Wolf, Joffrey; César, Vincent; Labande, Agnès; Poli, Rinaldo; Lugan, Noël; Lavigne, Guy |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 24 |
Pages of publication | 6981 |
a | 9.7482 ± 0.0004 Å |
b | 16.8095 ± 0.0007 Å |
c | 22.2652 ± 0.0009 Å |
α | 90° |
β | 95.755 ± 0.002° |
γ | 90° |
Cell volume | 3630 ± 0.3 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 6 |
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 | 0.031 |
Residual factor for significantly intense reflections | 0.0247 |
Weighted residual factors for significantly intense reflections | 0.0588 |
Weighted residual factors for all reflections included in the refinement | 0.0631 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.11 |
Diffraction radiation probe | x-ray |
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/4070449.html
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