Information card for entry 1576198

Structure parameters

• Formula: C48 H44 N6 O6 Pd S2
• Calculated formula: C48 H44 N6 O6 Pd S2
• Title of publication: Hangman Dipyrrin Complexes
• Authors of publication: Schomberg-Sanchez, Isaac S.; Robinson, William C.; Sanderson, Makayla E.; Mosquera, Martin A.; Lemon, Christopher M.
• Journal of publication: Chemical Science
• Year of publication: 2025
• a: 38.9049 ± 0.0011 Å
• b: 5.6739 ± 0.0002 Å
• c: 24.1051 ± 0.0006 Å
• α: 90°
• β: 126.913 ± 0.001°
• γ: 90°
• Cell volume: 4254.4 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0519
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0619
• Weighted residual factors for all reflections included in the refinement: 0.0685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No