Information card for entry 7703972

Structure parameters

• Formula: C39 H49 Mn3 N9 O6.75 S3
• Calculated formula: C39 H49 Mn3 N9 O6.75 S3
• Title of publication: Synthesis of Mn₃O₄ nanozymes from structurally characterized phenoxazinone synthase models based on manganese(iii) Schiff base complexes.
• Authors of publication: Mandal, Arnab; Dasgupta, Sanchari; Adhikary, Amit; Samanta, Debabrata; Zangrando, Ennio; Das, Debasis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 18
• Pages of publication: 5999 - 6011
• a: 14.004 ± 0.002 Å
• b: 14.366 ± 0.002 Å
• c: 14.52 ± 0.003 Å
• α: 67.61 ± 0.03°
• β: 61.177 ± 0.017°
• γ: 78.511 ± 0.019°
• Cell volume: 2365.9 ± 0.9 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.2359
• Residual factor for significantly intense reflections: 0.0987
• Weighted residual factors for significantly intense reflections: 0.229
• Weighted residual factors for all reflections included in the refinement: 0.2776
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No