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Information card for entry 4073427
Preview
Coordinates | 4073427.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H54 F3 Mo N3 O3 S |
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Calculated formula | C44 H54 F3 Mo N3 O3 S |
SMILES | [Mo]123(OS(=O)(=O)C(F)(F)F)(=Nc4c(cccc4C(C)C)C(C)C)[N](=C([C@H]([C]3(=[N]1c1c(cccc1C)C2)C)CC(C)(C)c1ccccc1)C)c1c(cccc1C)C |
Title of publication | Molybdenum Imido Alkylidene Complexes that Contain a β-Diketiminate Ligand |
Authors of publication | Tonzetich, Zachary J.; Jiang, Annie J.; Schrock, Richard R.; Müller, Peter |
Journal of publication | Organometallics |
Year of publication | 2007 |
Journal volume | 26 |
Journal issue | 15 |
Pages of publication | 3771 |
a | 10.755 ± 0.0005 Å |
b | 17.4054 ± 0.0009 Å |
c | 22.5561 ± 0.0012 Å |
α | 90° |
β | 92.02 ± 0.002° |
γ | 90° |
Cell volume | 4219.8 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.045 |
Residual factor for significantly intense reflections | 0.0389 |
Weighted residual factors for significantly intense reflections | 0.0765 |
Weighted residual factors for all reflections included in the refinement | 0.0782 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
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/4073427.html
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Users of the data should acknowledge the original authors of the
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