Information card for entry 7715077

Structure parameters

• Formula: C12 H10 Mo O8
• Calculated formula: C12 H10 Mo O8
• Title of publication: Molybdenum-maltolate as a molybdopterin mimic for bioinspired oxidation reaction.
• Authors of publication: Pawar, Swapnil S.; Ketkar, Rohit N.; Gaware, Pranav B.; Jagushte, Kaustubh U.; Dhawne, Divyani; Save, Shreyada N.; Sharma, Shilpy; Periyasamy, Ganga; Chimthanawala, Niyamat; Sathaye, Sadhana; Joshi, Shreerang V.; Sadhukhan, Nabanita
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 13
• Pages of publication: 5770 - 5774
• a: 10.0766 ± 0.0011 Å
• b: 10.5933 ± 0.0012 Å
• c: 12.4062 ± 0.0012 Å
• α: 90°
• β: 93.045 ± 0.004°
• γ: 90°
• Cell volume: 1322.4 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0176
• Residual factor for significantly intense reflections: 0.0171
• Weighted residual factors for significantly intense reflections: 0.0458
• Weighted residual factors for all reflections included in the refinement: 0.0461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No