Information card for entry 4061693

Structure parameters

• Formula: C37 H58 B Cl2 F4 Mo2 N2 O2 P
• Calculated formula: C37 H58 B Cl2 F4 Mo2 N2 O2 P
• SMILES: [Mo]1234567([Mo]89%10%11%12([P]1(C1CCCCC1)C1CCCCC1)([C]2(OC)=[C]38OC)(C#[N]C(C)(C)C)[cH]1[cH]9[cH]%10[cH]%11[cH]%121)(C#[N]C(C)(C)C)[cH]1[cH]4[cH]5[cH]6[cH]71.[B](F)(F)(F)[F-].C(Cl)Cl
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 9.2905 ± 0.0019 Å
• b: 17.63 ± 0.004 Å
• c: 25.898 ± 0.005 Å
• α: 90°
• β: 94.555 ± 0.004°
• γ: 90°
• Cell volume: 4228.5 ± 1.5 ų
• Cell temperature: 393 ± 2 K
• Ambient diffraction temperature: 393 ± 2 K
• Number of distinct elements: 9
• 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