Information card for entry 7716877

Structure parameters

• Formula: C36 H46 N8
• Calculated formula: C36 H46 N8
• Title of publication: Dinuclear tricarbonylrhenium(I) complexes: Impact of regioisomerism on the photoluminescence properties
• Authors of publication: Le Garrec, Stéphen; Martins-Bessa, David; Wolff, Mariusz; Delavaux-Nicot, Beatrice; Mallet-Ladeira, Sonia; Serpentini, Charles-Louis; Benoist, Eric; Bedos-Belval, Florence; Fery-Forgues, Suzanne
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 20.3002 ± 0.0015 Å
• b: 8.9187 ± 0.0006 Å
• c: 20.5373 ± 0.0014 Å
• α: 90°
• β: 116.516 ± 0.003°
• γ: 90°
• Cell volume: 3327.2 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 3
• 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: 0.1034
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.1536
• Weighted residual factors for all reflections included in the refinement: 0.1798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No