Information card for entry 7058976

Structure parameters

• Formula: C15 H15 Mo N3 O5
• Calculated formula: C15 H15 Mo N3 O5
• Title of publication: Discrete mononuclear and dinuclear compounds containing a MoO22+ core and 4-aminobenzhydrazone ligands: synthesis, structure and organic-solvent-free epoxidation activity
• Authors of publication: Cvijanović, Danijela; Pisk, Jana; Pavlović, Gordana; Šišak-Jung, Dubravka; Matković-Čalogović, Dubravka; Cindrić, Marina; Agustin, Dominique; Vrdoljak, Višnja
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 4
• Pages of publication: 1791
• a: 7.252 ± 0.0003 Å
• b: 10.1453 ± 0.0003 Å
• c: 11.3074 ± 0.0005 Å
• α: 79.677 ± 0.003°
• β: 75.793 ± 0.003°
• γ: 71.147 ± 0.003°
• Cell volume: 758.68 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0323
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.0579
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No