Information card for entry 7057602

Structure parameters

• Formula: C28 H42 I3 Mn N4 O6
• Calculated formula: C28 H42 I3 Mn N4 O6
• Title of publication: Portraying the role of halo ligands and the auxiliary part of ligands of mononuclear manganese(iii)-Schiff base complexes in catalyzing phospho‒ester bond hydrolysis
• Authors of publication: Chakraborty, Tonmoy; Dasgupta, Sanchari; Zangrando, Ennio; Das, Debasis
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 18
• Pages of publication: 14933
• a: 9.487 ± 0.001 Å
• b: 10.508 ± 0.002 Å
• c: 10.717 ± 0.001 Å
• α: 89.83 ± 0.005°
• β: 69.668 ± 0.004°
• γ: 63.17 ± 0.004°
• Cell volume: 878.7 ± 0.2 ų
• Cell temperature: 268 ± 2 K
• Ambient diffraction temperature: 268 ± 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: 0.0833
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1486
• Weighted residual factors for all reflections included in the refinement: 0.1725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No