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Information card for entry 4071121
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Coordinates | 4071121.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [Rh(S(O)NN*)(CO] |
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Chemical name | [Rh(S(O)NN*)(CO)] 8 |
Formula | C16 H25 N2 O2 Rh S |
Calculated formula | C16 H25 N2 O2 Rh S |
SMILES | [Rh]12([S](=O)(C(C)(C)C)C=c3n1c(ccc3)C[N]2(CC)CC)C#[O] |
Title of publication | Pyridine-Based Sulfoxide Pincer Complexes of Rhodium and Iridium |
Authors of publication | Schaub, Thomas; Radius, Udo; Diskin-Posner, Yael; Leitus, Gregory; Shimon, Linda J. W.; Milstein, David |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 8 |
Pages of publication | 1892 |
a | 10.2627 ± 0.0001 Å |
b | 10.8734 ± 0.0002 Å |
c | 15.8663 ± 0.0003 Å |
α | 89.5308 ± 0.0008° |
β | 85.4696 ± 0.001° |
γ | 88.7646 ± 0.001° |
Cell volume | 1764.55 ± 0.05 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0605 |
Residual factor for significantly intense reflections | 0.039 |
Weighted residual factors for significantly intense reflections | 0.0919 |
Weighted residual factors for all reflections included in the refinement | 0.1007 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
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/4071121.html
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Users of the data should acknowledge the original authors of the
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