Information card for entry 7217760

Structure parameters

• Chemical name: methanol(pyridoxal-isonicotinoyl -hydrazone- N,O,O)-dioxa-molybdenum(VI)
• Formula: C15 H16 Mo N4 O6
• Calculated formula: C15 H16 Mo N4 O6
• Title of publication: Pyridoxal hydrazonato molybdenum(VI) complexes: Assembly, Structure and Epoxidation (Pre)Catalyst testing under solvent-free conditions
• Authors of publication: Pisk, Jana; Prugovečki, Biserka; Matković-Čalogović, Dubravka; Jednačak, Tomislav; Novak, Predrag; Agustin, Dominique; Vrdoljak, Visnja
• Journal of publication: RSC Advances
• Year of publication: 2014
• a: 7.7 ± 0.006 Å
• b: 8.392 ± 0.005 Å
• c: 13.071 ± 0.007 Å
• α: 99.59 ± 0.05°
• β: 99.5 ± 0.06°
• γ: 93.09 ± 0.06°
• Cell volume: 818.5 ± 0.9 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.035
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0624
• Weighted residual factors for all reflections included in the refinement: 0.0637
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No