Information card for entry 2201446

Structure parameters

• Chemical name: (Acetylacetonato)bis(1,10'-phenanthroline-N,N')manganese(II) perchlorate
• Formula: C29 H23 Cl Mn N4 O6
• Calculated formula: C29 H23 Cl Mn N4 O6
• SMILES: [Mn]123(OC(=CC(=[O]1)C)C)([n]1cccc4ccc5ccc[n]2c5c14)[n]1cccc2ccc4ccc[n]3c4c12.Cl(=O)(=O)(=O)[O-]
• Title of publication: (Acetylacetonato)bis(1,10'-phenanthroline-<i>N</i>,<i>N</i>')manganese(II) perchlorate
• Authors of publication: Zhang, Xiaofeng; Huang, Deguang; Ma, Chengbing; Chen, Changneng; Liu, Qiutian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 9
• Pages of publication: m473 - m475
• a: 33.3452 ± 0.0004 Å
• b: 10.5753 ± 0.0001 Å
• c: 17.1597 ± 0.0003 Å
• α: 90°
• β: 110.05°
• γ: 90°
• Cell volume: 5684.38 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.11
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.155
• Weighted residual factors for all reflections included in the refinement: 0.191
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes