Information card for entry 7104441

Structure parameters

• Formula: C194 H148 Mn25 N24 O72
• Calculated formula: C194 H148 Mn25 N24 O72
• Title of publication: Azide groups in high oxidation state Mn carboxylate chemistry: a new Mn(11) complex and its conversion to a Mn(25) azide complex with Me(3)SiN(3).
• Authors of publication: Stamatatos, Theocharis C; Vinslava, Alina; Abboud, Khalil A; Christou, George
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 20
• Pages of publication: 2839 - 2841
• a: 20.3146 ± 0.0012 Å
• b: 20.3315 ± 0.0012 Å
• c: 27.2029 ± 0.0015 Å
• α: 86.097 ± 0.001°
• β: 76.095 ± 0.001°
• γ: 78.658 ± 0.001°
• Cell volume: 10690.7 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2546
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1129
• Weighted residual factors for all reflections included in the refinement: 0.1391
• Goodness-of-fit parameter for all reflections included in the refinement: 0.727
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No