Information card for entry 7711443

Structure parameters

• Formula: C42 H54 N5 Zn
• Calculated formula: C42 H54 N5 Zn
• Title of publication: Synthesis of low oxidation state zinc(i) complexes and their catalytic studies in the dehydroborylation of terminal alkynes
• Authors of publication: Sahoo, Rajata Kumar; Rajput, Sagrika; Patro, A. Ganesh; Nembenna, Sharanappa
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 18.0369 ± 0.0004 Å
• b: 16.9127 ± 0.0004 Å
• c: 27.672 ± 0.0006 Å
• α: 90°
• β: 104.82 ± 0.002°
• γ: 90°
• Cell volume: 8160.6 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0346
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0807
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No