Information card for entry 1576941

Structure parameters

• Formula: C48 H57 N2 O4 Si2 V
• Calculated formula: C48 H57 N2 O4 Si2 V
• Title of publication: Toward vanadium-mediated alkyne metathesis
• Authors of publication: Hernandez, Shirley; Krivovicheva, Vasilisa; Sousa-Silva, Adenilson; Solans-Monfort, Xavier; Bukhryakov, Konstantin V.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 22.221 ± 0.0002 Å
• b: 10.8997 ± 0.0001 Å
• c: 20.6591 ± 0.0002 Å
• α: 90°
• β: 114.065 ± 0.001°
• γ: 90°
• Cell volume: 4568.78 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0394
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No