Information card for entry 2221123

Structure parameters

• Chemical name: [2,4-Bis(diphenylphosphino)pentane- κ^2^<i>P</i>,<i>P</i>']tetracarbonylchromium(0)
• Formula: C33 H30 Cr O4 P2
• Calculated formula: C33 H30 Cr O4 P2
• SMILES: [Cr]1([P](c2ccccc2)(c2ccccc2)[C@H](C[C@@H]([P]1(c1ccccc1)c1ccccc1)C)C)(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: [1,3-Bis(diphenylphosphino)pentane-κ^2^<i>P</i>,<i>P</i>']tetracarbonylchromium(0)
• Authors of publication: Shawkataly, Omar bin; Thangadurai, Daniel T.; Pankhi, Mohd. Aslam A.; Shahinoor Dulal Islam, S. M.; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: m250 - m251
• a: 13.3013 ± 0.0002 Å
• b: 14.2333 ± 0.0002 Å
• c: 15.6694 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2966.55 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0409
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0673
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes