Information card for entry 1543411

Structure parameters

• Formula: C47 H34 Cl2 N6 O20 Pd3 S6
• Calculated formula: C47 H34 Cl2 N6 O20 Pd3 S6
• Title of publication: Regioselective Intermolecular Diamination and Aminooxygenation of Alkenes with Saccharin.
• Authors of publication: Martínez, Claudio; Pérez, Edwin G; Iglesias, Álvaro; Escudero-Adán, Eduardo C; Muñiz, Kilian
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 12
• Pages of publication: 2998 - 3001
• a: 11.6132 ± 0.0008 Å
• b: 11.8042 ± 0.0009 Å
• c: 22.2493 ± 0.0017 Å
• α: 86.411 ± 0.003°
• β: 75.439 ± 0.003°
• γ: 84.592 ± 0.002°
• Cell volume: 2936.5 ± 0.4 ų
• Cell temperature: 100 ± 2 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: 0.0701
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1426
• Weighted residual factors for all reflections included in the refinement: 0.161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No