Information card for entry 7243979

Structure parameters

• Formula: C16 H19 Cl N2 O
• Calculated formula: C16 H19 Cl N2 O
• Title of publication: A carbon dioxide-promoted three-component Strecker reaction
• Authors of publication: Fauziev, Ruslan V.; Ivanov, Roman E.; Kuchurov, Ilya V.; Zlotin, Sergei G.
• Journal of publication: Green Chemistry
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 24
• Pages of publication: 10137 - 10144
• a: 7.78804 ± 0.00005 Å
• b: 10.18953 ± 0.00007 Å
• c: 19.93923 ± 0.00014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1582.31 ± 0.019 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0249
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0639
• Weighted residual factors for all reflections included in the refinement: 0.0642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No