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Information card for entry 4069623
Preview
Coordinates | 4069623.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H42 N2 O Si W |
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Calculated formula | C27 H42 N2 O Si W |
SMILES | CC/C=C/C1=[N](c2c(cccc2C)C)[W]23451(C[Si](C)(C)C)([c]1([c]2([c]3([c]4([c]51C)C)C)C)C)N=O |
Title of publication | Toward Alkane Functionalization Effected with Cp*W(NO)(alkyl)(η3-allyl) Complexes |
Authors of publication | Semproni, Scott P.; Graham, Peter M.; Buschhaus, Miriam S. A.; Patrick, Brian O.; Legzdins, Peter |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 15 |
Pages of publication | 4480 |
a | 9.7644 ± 0.0008 Å |
b | 16.7802 ± 0.0014 Å |
c | 17.2285 ± 0.0015 Å |
α | 90° |
β | 91.998 ± 0.004° |
γ | 90° |
Cell volume | 2821.1 ± 0.4 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0255 |
Residual factor for significantly intense reflections | 0.0181 |
Weighted residual factors for significantly intense reflections | 0.0392 |
Weighted residual factors for all reflections included in the refinement | 0.042 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4069623.html
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