Information card for entry 1576939

Structure parameters

• Formula: C37 H48 N O Si3 V
• Calculated formula: C37 H48 N O Si3 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: 11.8811 ± 0.0007 Å
• b: 14.3289 ± 0.0009 Å
• c: 22.4754 ± 0.0014 Å
• α: 90°
• β: 100.081 ± 0.001°
• γ: 90°
• Cell volume: 3767.2 ± 0.4 ų
• Cell temperature: 172 ± 2 K
• Ambient diffraction temperature: 172 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No