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Information card for entry 4063752
Preview
Coordinates | 4063752.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C14 H21 Mo N O |
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Calculated formula | C14 H21 Mo N O |
SMILES | [CH2]1=[CH]2[CH]3=[CH2][Mo]4567123([c]1([c]4([c]5([c]6([c]71C)C)C)C)C)N=O |
Title of publication | Differing Reactions of Functionalized Hydrocarbons with Cp*M(NO)(alkyl)(η3-allyl) Complexes of Molybdenum and Tungsten |
Authors of publication | Tran, Tommy; Chow, Catherine; Zimmerman, Amanda C.; Thibault, Michelle E.; McNeil, W. Stephen; Legzdins, Peter |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 4 |
Pages of publication | 738 |
a | 8.0187 ± 0.0012 Å |
b | 13.3671 ± 0.0019 Å |
c | 13.257 ± 0.002 Å |
α | 90° |
β | 103.58 ± 0.006° |
γ | 90° |
Cell volume | 1381.2 ± 0.4 Å3 |
Cell temperature | 103 ± 2 K |
Ambient diffraction temperature | 103 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0202 |
Residual factor for significantly intense reflections | 0.0186 |
Weighted residual factors for significantly intense reflections | 0.0487 |
Weighted residual factors for all reflections included in the refinement | 0.0495 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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