Information card for entry 7707068

Structure parameters

• Formula: C22 H24 Mn2 N6 O8
• Calculated formula: C22 H24 Mn2 N6 O8
• Title of publication: Manganese complexes with chelating and bridging di-triazolylidene ligands: synthesis and reactivity.
• Authors of publication: Friães, Sofia; Realista, Sara; Gomes, Clara S. B.; Martinho, Paulo N.; Veiros, Luis F.; Albrecht, Martin; Royo, Beatriz
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 17
• Pages of publication: 5911 - 5920
• a: 12.2841 ± 0.0006 Å
• b: 16.224 ± 0.0008 Å
• c: 13.1914 ± 0.0006 Å
• α: 90°
• β: 103.688 ± 0.002°
• γ: 90°
• Cell volume: 2554.3 ± 0.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• 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: 0.1593
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1667
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No