Information card for entry 7716166

Structure parameters

• Formula: C47 H63 N4 P Se Zn
• Calculated formula: C47 H63 N4 P Se Zn
• Title of publication: Tri-coordinated zinc alkyl complexes with N^S/Se coordination of imino-phosphanamidinate chalcogenide ligands as precursors for efficient hydroboration of nitriles and esters
• Authors of publication: Karmakar, Himadri; Kumar, Gobbilla Sai; Pal, Kuntal; Chandrasekhar, Vadapalli; Kanti Panda, Tarun
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 9.6029 ± 0.0004 Å
• b: 38.6821 ± 0.0018 Å
• c: 12.204 ± 0.0005 Å
• α: 90°
• β: 101.243 ± 0.004°
• γ: 90°
• Cell volume: 4446.3 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0798
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1004
• Weighted residual factors for all reflections included in the refinement: 0.1076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No