Information card for entry 4076253

Structure parameters

• Formula: C78 H150 Mo6 N6 O30
• Calculated formula: C78 H150 Mo6 N6 O30
• 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: 10.039 ± 0.004 Å
• b: 44.648 ± 0.016 Å
• c: 21.756 ± 0.008 Å
• α: 90°
• β: 90.143 ± 0.018°
• γ: 90°
• Cell volume: 9751 ± 6 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0592
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1404
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No