Information card for entry 7709287

Structure parameters

• Formula: C14 H32 Cl2 N2 O4 Pd
• Calculated formula: C14 H32 Cl2 N2 O4 Pd
• Title of publication: Quadrol-Pd(II) complexes: phosphine-free precatalysts for the room-temperature Suzuki-Miyaura synthesis of nucleoside analogues in aqueous media
• Authors of publication: Serrano, Jose Luis; Gaware, Sujeet; Pérez de Haro, Jose Antonio; Pérez, Jose; Lozano, Pedro; Kori, Santosh; Dandela, Rambabu; Sanghvi, Yogesh S.; Kapdi, Anant R.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.0082 ± 0.0005 Å
• b: 11.6508 ± 0.0008 Å
• c: 18.8174 ± 0.0012 Å
• α: 90°
• β: 90.478 ± 0.003°
• γ: 90°
• Cell volume: 1974.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0704
• Residual factor for significantly intense reflections: 0.0569
• Weighted residual factors for significantly intense reflections: 0.1391
• Weighted residual factors for all reflections included in the refinement: 0.1474
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No