Information card for entry 4076250

Structure parameters

• Formula: C36 H69 Mo3 N3 O12
• Calculated formula: C36.008 H69.14 Mo3 N3.001 O12
• Title of publication: Synthesis and Characterization of Bi- and Trinuclear Molybdenum Carbonyl Compounds Obtained by Ligand Exchange Reactions of [Et4N]3[Mo3(CO)9(OMe)3]
• Authors of publication: Adrian, Rafael A.; Yaklin, Marsha M.; Klausmeyer, Kevin K.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 6
• Pages of publication: 1352
• a: 11.7204 ± 0.0009 Å
• b: 11.7204 ± 0.0009 Å
• c: 31.957 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4389.9 ± 0.7 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 138
• Hermann-Mauguin space group symbol: P 42/n c m :2
• Hall space group symbol: -P 4ac 2ac
• Residual factor for all reflections: 0.0944
• Residual factor for significantly intense reflections: 0.0622
• Weighted residual factors for significantly intense reflections: 0.1258
• Weighted residual factors for all reflections included in the refinement: 0.1356
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No