Information card for entry 4023158

Structure parameters

• Formula: C7 H10 B N
• Calculated formula: C7 H10 B N
• Title of publication: 3-(Dimethylboryl)pyridine: Synthesis, Structure, and Remarkable Steric Effects in Scrambling Reactions
• Authors of publication: Shigeharu Wakabayashi; Saori Imamura; Yoshikazu Sugihara; Makoto Shimizu; Toshikazu Kitagawa; Yasuhiro Ohki; Kazuyuki Tatsumi
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2008
• Journal volume: 73
• Pages of publication: 81 - 87
• a: 10.523 ± 0.007 Å
• b: 12.722 ± 0.008 Å
• c: 10.611 ± 0.007 Å
• α: 90°
• β: 95.168 ± 0.009°
• γ: 90°
• Cell volume: 1414 ± 1 ų
• Cell temperature: 173.2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for all reflections included in the refinement: 0.0641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.453
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No