Information card for entry 7063346

Structure parameters

• Chemical name: N-(1-(bromomethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-yl)methanesulfonamide
• Formula: C11 H20 Br N O2 S
• Calculated formula: C11 H20 Br N O2 S
• Title of publication: Halosulfonamidation of camphene: chemo and stereoselectivity, rearrangement, solvent interception, heterocyclization
• Authors of publication: Moskalik, Mikhail Yu.; Garagan, Ivan A.; Shainyan, Bagrat A.; Yarovaya, Olga I.; Ganin, Anton S.; Astakhova, Vera V.; Sterkhova, Irina V.; Zinchenko, Sergey V.; Salakhutdinov, Nariman F.; Radzhabov, Amirbek D.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• Journal volume: 48
• Journal issue: 30
• Pages of publication: 13506 - 13513
• a: 7.546 ± 0.004 Å
• b: 8.634 ± 0.004 Å
• c: 10.975 ± 0.005 Å
• α: 75.459 ± 0.014°
• β: 80.375 ± 0.016°
• γ: 83.214 ± 0.015°
• Cell volume: 680.2 ± 0.6 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1647
• Residual factor for significantly intense reflections: 0.0775
• Weighted residual factors for significantly intense reflections: 0.172
• Weighted residual factors for all reflections included in the refinement: 0.1989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No