Information card for entry 7110612

Structure parameters

• Formula: C19 H14 Cl2 Mo N2 O5
• Calculated formula: C19 H12 Cl2 Mo N2 O5
• Title of publication: Novel oxo-peroxo molybdenum(VI) complexes incorporating 8-quinolinol: synthesis, structure and catalytic uses in the environmentally benign and cost-effective oxidation method of methyl benzenes: Ar(CH3)n (n = 1, 2)
• Authors of publication: Bandyopadhyay, Ratna; Biswas, Sudeb; Bhattacharyya, Ramgopal; Guha, Subhadra; Mukherjee, Alok K.
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 17
• Pages of publication: 1627
• a: 9.7912 ± 0.001 Å
• b: 10.643 ± 0.001 Å
• c: 10.9638 ± 0.001 Å
• α: 117.7 ± 0.01°
• β: 90.14 ± 0.01°
• γ: 105.08 ± 0.01°
• Cell volume: 966.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for all reflections: 0.1235
• Weighted residual factors for significantly intense reflections: 0.119
• Goodness-of-fit parameter for all reflections: 1.099
• Goodness-of-fit parameter for significantly intense reflections: 1.124
• Diffraction radiation wavelength: 0.71093 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No