Information card for entry 7000637

Structure parameters

• Formula: C38 H50 N2 Ni O4
• Calculated formula: C38 H50 N2 Ni O4
• Title of publication: One-electron oxidized nickel(II) complexes of bis and tetra(salicylidene) phenylenediamine Schiff bases: from monoradical to interacting Ni(III) ions
• Authors of publication: Rotthaus, Olaf; Jarjayes, Olivier; Philouze, Christian; Del Valle, Carlos Pérez; Thomas, Fabrice
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 10
• Pages of publication: 1792 - 1800
• a: 29.792 ± 0.004 Å
• b: 19.255 ± 0.002 Å
• c: 13.8064 ± 0.0006 Å
• α: 90°
• β: 117.44 ± 0.01°
• γ: 90°
• Cell volume: 7028.9 ± 1.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• 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: 0.0613
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections: 0.0751
• Weighted residual factors for all reflections included in the refinement: 0.0751
• Goodness-of-fit parameter for all reflections: 1.31
• Goodness-of-fit parameter for all reflections included in the refinement: 1.31
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No