Information card for entry 7716879

Structure parameters

• Formula: C75 H98 N16 O
• Calculated formula: C75 H98 N16 O
• 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, Béatrice; Mallet-Ladeira, Sonia; Serpentini, Charles-Louis; Benoist, Eric; Bedos-Belval, Florence; Fery-Forgues, Suzanne
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 40
• Pages of publication: 16512 - 16529
• a: 9.1394 ± 0.0009 Å
• b: 20.29 ± 0.002 Å
• c: 20.328 ± 0.002 Å
• α: 75.123 ± 0.004°
• β: 79.003 ± 0.004°
• γ: 82.681 ± 0.004°
• Cell volume: 3564.1 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1263
• Residual factor for significantly intense reflections: 0.0709
• Weighted residual factors for significantly intense reflections: 0.2011
• Weighted residual factors for all reflections included in the refinement: 0.239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No