Information card for entry 7248145

Structure parameters

• Formula: C38 H27 Co N12 O15 Tb
• Calculated formula: C38 H27 Co N12 O15 Tb
• Title of publication: Union is strength: π–π stacking interactions are capable of preventing solid-state racemization of tris-chelate complexes
• Authors of publication: Gavrikov, Andrey V.; Ilyukhin, Andrey B.
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 12
• Pages of publication: 1677 - 1682
• a: 27.417 ± 0.002 Å
• b: 13.0209 ± 0.0012 Å
• c: 27.138 ± 0.002 Å
• α: 90°
• β: 104.446 ± 0.003°
• γ: 90°
• Cell volume: 9381.8 ± 1.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1071
• Residual factor for significantly intense reflections: 0.0836
• Weighted residual factors for significantly intense reflections: 0.196
• Weighted residual factors for all reflections included in the refinement: 0.2126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.179
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No