Information card for entry 7715563

Structure parameters

• Formula: C750 H1200 Fe2 N150 O75
• Calculated formula: C36 H21 Fe N3 O3
• Title of publication: Designing one-compartment H₂O₂ fuel cell using electroactive phenalenyl-based [Fe₂(hnmh-PLY)₃] complex as the cathode material.
• Authors of publication: Kamboj, Nisha; Dey, Ayan; Birara, Sunita; Majumder, Moumita; Sengupta, Srijan; Metre, Ramesh K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 16
• Pages of publication: 7152 - 7162
• a: 13.2008 ± 0.0016 Å
• b: 15.706 ± 0.002 Å
• c: 16.0595 ± 0.0017 Å
• α: 81.353 ± 0.004°
• β: 77.826 ± 0.004°
• γ: 67.397 ± 0.004°
• Cell volume: 2995.9 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.1027
• Residual factor for significantly intense reflections: 0.0773
• Weighted residual factors for significantly intense reflections: 0.188
• Weighted residual factors for all reflections included in the refinement: 0.2004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.221
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No