Information card for entry 7710877

Structure parameters

• Formula: C24 H22 N4 Ni S6
• Calculated formula: C24 H22 N4 Ni S6
• Title of publication: Homoleptic Ni(II) Dithiocarbamate Complexes as Pre-catalysts for Electrocatalytic Oxygen Evolution Reaction
• Authors of publication: Pal, Sarvesh Kumar; Singh, Baghendra; Yadav, Jitendra Kumar; Yadav, Chote Lal; Drew, Michael G. B.; Singh, Nanhai; Indra, Arindam; Kumar, Kamlesh
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 6.191 ± 0.003 Å
• b: 10.226 ± 0.004 Å
• c: 10.769 ± 0.005 Å
• α: 77.765 ± 0.01°
• β: 73.925 ± 0.01°
• γ: 87.279 ± 0.011°
• Cell volume: 640.2 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1299
• Residual factor for significantly intense reflections: 0.0827
• Weighted residual factors for significantly intense reflections: 0.2205
• Weighted residual factors for all reflections included in the refinement: 0.2446
• Goodness-of-fit parameter for all reflections included in the refinement: 1.162
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No