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Information card for entry 4086764
Preview
Coordinates | 4086764.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C53 H70 O3 Si W |
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Calculated formula | C53 H70 O3 Si W |
SMILES | [W]12345(=[Si](OC1(c1ccccc1)c1ccccc1)c1c6c(cc7c1C(CC7(CC)CC)(CC)CC)C(CC6(CC)CC)(CC)CC)(C#[O])(C#[O])[c]1([c]2([c]3([c]4([c]51C)C)C)C)C |
Title of publication | A Silylyne Tungsten Complex Having an Eind Group on Silicon: Its Dimer‒Monomer Equilibrium and Cycloaddition Reactions with Carbodiimide and Diaryl Ketones |
Authors of publication | Takashi Yoshimoto; Hisako Hashimoto; Naoki Hayakawa; Tsukasa Matsuo; Hiromi Tobita |
Journal of publication | Organometallics |
Year of publication | 2016 |
Pages of publication | 3444 - 3447 |
a | 10.2995 ± 0.0005 Å |
b | 13.3593 ± 0.0006 Å |
c | 17.9891 ± 0.0009 Å |
α | 99.1384 ± 0.0019° |
β | 105.609 ± 0.0017° |
γ | 100 ± 0.002° |
Cell volume | 2291.9 ± 0.19 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.095 |
Residual factor for significantly intense reflections | 0.0746 |
Weighted residual factors for significantly intense reflections | 0.1566 |
Weighted residual factors for all reflections included in the refinement | 0.1667 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.172 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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