Information card for entry 7714543

Structure parameters

• Formula: C38 H31 B Co F2 N4 O7
• Calculated formula: C38 H31 B Co F2 N4 O7
• Title of publication: A mixed-ligand Co metal-organic framework and its carbon composites as excellent electrocatalysts for the oxygen evolution reaction in green-energy devices.
• Authors of publication: Gupta, Gajendra; Gusmão, Filipe; Paul, Anup; Šljukić, Biljana; Santos, Diogo M. F.; Lee, Junseong; Guedes da Silva, M Fátima C; Pombeiro, Armando J. L.; Lee, Chang Yeon
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 11
• Pages of publication: 5001 - 5009
• a: 10.3351 ± 0.0004 Å
• b: 10.7704 ± 0.0004 Å
• c: 15.9693 ± 0.0005 Å
• α: 91.472 ± 0.002°
• β: 100.354 ± 0.002°
• γ: 103.714 ± 0.002°
• Cell volume: 1694.45 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1237
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No