Information card for entry 7124595

Structure parameters

• Common name: 6MACdippHCl
• Formula: C21 H32 Cl N O
• Calculated formula: C21 H32 Cl N O
• Title of publication: A cyclic (alkyl)(amido)carbene: synthesis, study and utility as a desulfurization reagent.
• Authors of publication: McCarty, Zachary R.; Lastovickova, Dominika N.; Bielawski, Christopher W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 31
• Pages of publication: 5447 - 5450
• a: 11.6015 ± 0.0019 Å
• b: 12.822 ± 0.002 Å
• c: 13.428 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1997.5 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0441
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.1096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No