Information card for entry 4100983

Structure parameters

• Formula: C32 H20 Mo2 O10 P2
• Calculated formula: C32 H20 Mo2 O10 P2
• SMILES: [Mo]([P@@]1([C@@H]2c3ccccc3[C@@H]([P@]([Mo](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(C2)c2ccccc2)C1)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O].[Mo]([P@]1([C@H]2c3ccccc3[C@H]([P@@]([Mo](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(C2)c2ccccc2)C1)c1ccccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: 3H-Benzophosphepine Complexes: Versatile Phosphinidene Precursors
• Authors of publication: Borst, Mark L. G.; Bulo, Rosa E.; Gibney, Daniele J.; Alem, Yonathan; de Kanter, Franciscus J. J.; Ehlers, Andreas W.; Schakel, Marius; Lutz, Martin; Spek, Anthony L.; Lammertsma, Koop
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 9.0413 ± 0.0001 Å
• b: 21.6707 ± 0.0003 Å
• c: 17.8474 ± 0.0003 Å
• α: 90°
• β: 111.977 ± 0.0005°
• γ: 90°
• Cell volume: 3242.75 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No