Information card for entry 7028832

Structure parameters

• Common name: [[Mn(dpaqCl)(NO)]ClO4
• Formula: C23 H19 Cl2 Mn N6 O6
• Calculated formula: C23 H19 Cl2 Mn N6 O6
• Title of publication: Electronic tuning of nitric oxide release from manganese nitrosyl complexes by visible light irradiation: enhancement of nitric oxide release efficiency by the nitro-substituted quinoline ligand.
• Authors of publication: Hitomi, Yutaka; Iwamoto, Yuji; Kodera, Masahito
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 5
• Pages of publication: 2161 - 2167
• a: 8.8812 ± 0.0001 Å
• b: 10.1471 ± 0.0001 Å
• c: 26.2914 ± 0.0005 Å
• α: 90°
• β: 92.9655 ± 0.0008°
• γ: 90°
• Cell volume: 2366.17 ± 0.06 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0424
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No