Information card for entry 4062703

Structure parameters

• Formula: C15 H12 B Br F4 Mo O6
• Calculated formula: C15 H12 B Br F4 Mo O6
• SMILES: [Mo]1234(C#[O])([O]=C5OC(=CC(=C5Br)OC)C)(C#[O])(C#[O])[cH]5[cH]3[cH]2[cH]1[cH]45.[B](F)(F)(F)[F-]
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 7.6608 ± 0.0004 Å
• b: 24.8663 ± 0.0013 Å
• c: 9.9833 ± 0.0006 Å
• α: 90°
• β: 100.445 ± 0.001°
• γ: 90°
• Cell volume: 1870.26 ± 0.18 ų
• Cell temperature: 115 ± 2 K
• Ambient diffraction temperature: 115 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No