Information card for entry 7011383

Structure parameters

• Formula: C20 H22 Cl Mn N2 O2
• Calculated formula: C20 H22 Cl Mn N2 O2
• SMILES: [Mn]123(Cl)Oc4ccccc4C=[N]2C(C)(C)C([N]3=Cc2ccccc2O1)(C)C
• Title of publication: Out-of-plane dimers of Mn(III) quadridentate Schiff-base complexes with saltmen2− and naphtmen2− ligands: structure analysis and ferromagnetic exchange
• Authors of publication: Hitoshi Miyasaka; Rodolphe Clérac; Tomohiko Ishii; Ho-Chol Chang; Susumu Kitagawa; Masahiro Yamashita
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 7
• Pages of publication: 1528 - 1534
• a: 20.1584 ± 0.0005 Å
• b: 21.9138 ± 0.0005 Å
• c: 8.6859 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3836.97 ± 0.16 ų
• Cell temperature: 173.2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for all reflections included in the refinement: 0.0777
• Goodness-of-fit parameter for all reflections included in the refinement: 0.57
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No