Information card for entry 2011876

Structure parameters

• Chemical name: Pentacarbonyl(4-phenylpyridine)tungsten(0)
• Formula: C16 H9 N O5 W
• Calculated formula: C16 H9 N O5 W
• SMILES: [n]1([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])ccc(cc1)c1ccccc1
• Title of publication: Pentacarbonyl(4-phenylpyridine)tungsten(0) and pentacarbonyl(2-phenylpyridine)chromium(0)
• Authors of publication: Creaven, Bernadette S.; Howie, R. Alan; .; Long, Conor; .
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 4
• Pages of publication: 385 - 387
• a: 12.538 ± 0.004 Å
• b: 16.239 ± 0.006 Å
• c: 7.866 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1601.6 ± 1.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for all reflections included in the refinement: 0.072
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes