Information card for entry 4064304

Structure parameters

• Formula: C11 H15 N O
• Calculated formula: C11 H15 N O
• SMILES: c1(=O)cccccc1NC(C)(C)C
• Title of publication: Bulky Aminotroponiminate-Stabilized Germylene Monochloride and Its Alkyne Derivatives
• Authors of publication: Siwatch, Rahul Kumar; Kundu, Subrata; Kumar, Dinesh; Nagendran, Selvarajan
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 7
• Pages of publication: 1998
• a: 9.225 ± 0.003 Å
• b: 9.724 ± 0.004 Å
• c: 11.542 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1035.4 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0662
• Residual factor for significantly intense reflections: 0.0615
• Weighted residual factors for significantly intense reflections: 0.1659
• Weighted residual factors for all reflections included in the refinement: 0.1719
• Goodness-of-fit parameter for all reflections included in the refinement: 0.978
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No