Information card for entry 4064127

Structure parameters

• Formula: C29 H20 Cr O5 P4
• Calculated formula: C29 H20 Cr O5 P4
• SMILES: [Cr]([P]1(P(P(P1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Oligomerization of Terminal Phosphinidene Complexes
• Authors of publication: Tran Huy, Ngoc Hoa; Lu, Yunpeng; Mathey, François
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 6
• Pages of publication: 1734
• a: 10.2754 ± 0.0004 Å
• b: 22.3544 ± 0.0007 Å
• c: 14.0485 ± 0.0004 Å
• α: 90°
• β: 118.565 ± 0.002°
• γ: 90°
• Cell volume: 2834.15 ± 0.17 ų
• 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: 0.0469
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0723
• Weighted residual factors for all reflections included in the refinement: 0.0781
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No