Information card for entry 7135462

Structure parameters

• Formula: C66 H78 Cl2 Co N6 Ni3 O23
• Calculated formula: C66 H78 Cl2 Co N6 Ni3 O23
• Title of publication: Heterometallic molecular Ni-salen catalysts for efficient electrocatalytic oxygen evolution reaction.
• Authors of publication: Bhadauriya, Kiran; Goyal, Ayusie; Kumar, Rakesh; Singh, Baghendra; Draksharapu, Apparao
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2026
• Journal volume: 62
• Journal issue: 23
• Pages of publication: 6396 - 6399
• a: 12.1492 ± 0.0004 Å
• b: 15.5959 ± 0.0005 Å
• c: 18.6011 ± 0.0006 Å
• α: 89.457 ± 0.001°
• β: 78.403 ± 0.001°
• γ: 76.541 ± 0.001°
• Cell volume: 3355.15 ± 0.19 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0867
• Residual factor for significantly intense reflections: 0.0782
• Weighted residual factors for significantly intense reflections: 0.1723
• Weighted residual factors for all reflections included in the refinement: 0.1756
• Goodness-of-fit parameter for all reflections included in the refinement: 1.27
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No