Information card for entry 7126311

Structure parameters

• Formula: C11 H11 N3 O2
• Calculated formula: C11 H11 N3 O2
• Title of publication: Conformational control of N-methyl-N,N'-diacylhydrazines by noncovalent carbon bonding in solution.
• Authors of publication: Deka, Jugal Kishore Rai; Sahariah, Biswajit; Baruah, Kalpita; Bar, Arun Kumar; Sarma, Bani Kanta
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 36
• Pages of publication: 4874 - 4877
• a: 9.8467 ± 0.0005 Å
• b: 11.576 ± 0.0005 Å
• c: 9.697 ± 0.0004 Å
• α: 90°
• β: 90.927 ± 0.002°
• γ: 90°
• Cell volume: 1105.17 ± 0.09 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 296.98 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1097
• Weighted residual factors for all reflections included in the refinement: 0.1244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No