Information card for entry 4100558

Structure parameters

• Formula: C32 H41 Cl2 Mo O5 P
• Calculated formula: C32 H41 Cl2 Mo O5 P
• SMILES: [Mo]12345([P](O1)(Oc1ccc(O)cc1)c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)(C#[O])(C#[O])[cH]1[cH]2[cH]3[cH]4[cH]51.C(Cl)Cl
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 15.229 ± 0.002 Å
• b: 10.9352 ± 0.0017 Å
• c: 20.058 ± 0.003 Å
• α: 90°
• β: 103.385 ± 0.003°
• γ: 90°
• Cell volume: 3249.6 ± 0.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• 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