Information card for entry 7711237

Structure parameters

• Formula: C44 H51 N2 O4 Sb
• Calculated formula: C44 H51 N2 O4 Sb
• Title of publication: Beyond simple hetero Diels-Alder Cycloadditions. A New Type of Element-Ligand Cooperativity at N,C,N-coordinated Arsinidene and Stibinidene Centres in the Reaction with an Electron Deficient Alkyne.
• Authors of publication: Hejda, Martin; Zechovský, Jan; Kremláček, Vít; Erben, Milan; Rychagova, Elena A.; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey Yu.; Dostál, Libor
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 8.7928 ± 0.0003 Å
• b: 11.5342 ± 0.0004 Å
• c: 20.5702 ± 0.0007 Å
• α: 76.875 ± 0.002°
• β: 87.983 ± 0.002°
• γ: 77.437 ± 0.002°
• Cell volume: 1982.82 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0402
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0674
• Weighted residual factors for all reflections included in the refinement: 0.0702
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No