Information card for entry 4322170

Structure parameters

• Formula: C142 H84 Cl10 Mo3 N12 O12
• Calculated formula: C141.404 H90 Cl7.808 Mo3 N12 O11.972
• Title of publication: Molybdenum(V) on an Oxide String. Synthesis and Structure of the Novel Linear Trinuclear Complex {[MoO(TPP)][O-Mo(TPP)-O][MoO(TPP)]}ClO4
• Authors of publication: Brent J. Hamstra; Beisong Cheng; Mary K. Ellison; W. Robert Scheidt
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 3554 - 3561
• a: 26.428 ± 0.006 Å
• b: 18.683 ± 0.006 Å
• c: 28.692 ± 0.004 Å
• α: 90°
• β: 113.98 ± 0.02°
• γ: 90°
• Cell volume: 12944 ± 6 ų
• Cell temperature: 127 ± 2 K
• Ambient diffraction temperature: 127 ± 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
• Residual factor for all reflections: 0.171
• Residual factor for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections: 0.2524
• Weighted residual factors for significantly intense reflections: 0.1878
• Goodness-of-fit parameter for all reflections: 1.12
• Goodness-of-fit parameter for significantly intense reflections: 1.159
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No