Information card for entry 7719792

Structure parameters

• Formula: C72 H64 Mn2 N6 O16 S4
• Calculated formula: C72 H62 Mn2 N6 O16 S4
• Title of publication: Multiphoton excitation and energy transfer pathways in Mn²⁺-sulfonyl calixarene complexes.
• Authors of publication: Lecourt, Constance; Ledoux, Gilles; Suffren, Yan; Jeanneau, Erwann; Luneau, Dominique; Desroches, Cedric
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 46
• Pages of publication: 17151 - 17161
• a: 11.5988 ± 0.0003 Å
• b: 12.2057 ± 0.0004 Å
• c: 14.545 ± 0.0005 Å
• α: 66.945 ± 0.003°
• β: 88.638 ± 0.002°
• γ: 85.133 ± 0.002°
• Cell volume: 1887.76 ± 0.11 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.093
• Weighted residual factors for all reflections included in the refinement: 0.101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No