Information card for entry 7716741

Structure parameters

• Formula: C40 H49 N4 O2 Pd
• Calculated formula: C40 H49 N4 O2 Pd
• Title of publication: Ni(II) and Pd(II) complexes of a new redox-active pentadentate azo-appended 2-aminophenol ligand: Pd(II)-assisted intraligand cyclization forms a phenoxazinyl ring.
• Authors of publication: Bhowmik, Saumitra; Sengupta, Arunava; Mukherjee, Rabindranath
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 33
• Pages of publication: 14046 - 14064
• a: 9.6069 ± 0.0009 Å
• b: 11.3196 ± 0.001 Å
• c: 17.4614 ± 0.0016 Å
• α: 72.042 ± 0.003°
• β: 81.586 ± 0.003°
• γ: 89.255 ± 0.003°
• Cell volume: 1785.9 ± 0.3 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: 0.0472
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0824
• Weighted residual factors for all reflections included in the refinement: 0.0887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No