Information card for entry 7028831

Structure parameters

• Common name: [[Mn(dpaqCl)(NO)]ClO4
• Formula: C23 H20 Cl Mn N6 O6
• Calculated formula: C23 H20 Cl 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: 12.3007 ± 0.0005 Å
• b: 13.3626 ± 0.0006 Å
• c: 14.1948 ± 0.0007 Å
• α: 90°
• β: 107.07 ± 0.002°
• γ: 90°
• Cell volume: 2230.41 ± 0.18 ų
• Cell temperature: 123 ± 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1479
• Residual factor for significantly intense reflections: 0.108
• Weighted residual factors for significantly intense reflections: 0.2588
• Weighted residual factors for all reflections included in the refinement: 0.313
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No