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Information card for entry 4073200
Preview
Coordinates | 4073200.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28.5 H29 Cl Cr N O3 Rh |
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Calculated formula | C28.5 H29 Cl Cr N O3 Rh |
SMILES | [Rh]12345(Cl)([n]6cccc(c6[c]67[c]81[Cr]19%106([cH]8[cH]1[cH]9[cH]7%10)(C#[O])(C#[O])C#[O])C)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C.Cc1ccccc1 |
Title of publication | Stereoselective “Electrophilic” Cyclometalation of Planar-Prochiral (η6-Arene)tricarbonylchromium Complexes with Asymmetric Metal Centers: pseudo-T-4 [Cp*RhCl2]2and [Cp*IrCl2]2 |
Authors of publication | Scheeren, Carla; Maasarani, Fida; Hijazi, Akram; Djukic, Jean-Pierre; Pfeffer, Michel; Zarić, Snežana D.; Le Goff, Xavier-Frédéric; Ricard, Louis |
Journal of publication | Organometallics |
Year of publication | 2007 |
Journal volume | 26 |
Journal issue | 14 |
Pages of publication | 3336 |
a | 12.834 ± 0.001 Å |
b | 14.251 ± 0.001 Å |
c | 15.433 ± 0.001 Å |
α | 73.61 ± 0.001° |
β | 77.837 ± 0.001° |
γ | 85.641 ± 0.001° |
Cell volume | 2646.8 ± 0.3 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0503 |
Residual factor for significantly intense reflections | 0.0381 |
Weighted residual factors for significantly intense reflections | 0.104 |
Weighted residual factors for all reflections included in the refinement | 0.1105 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
Diffraction radiation wavelength | 0.71069 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/4073200.html
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Users of the data should acknowledge the original authors of the
structural data.