Information card for entry 4117431

Structure parameters

• Formula: C16 H18 N2 O Se
• Calculated formula: C16 H18 N2 O Se
• SMILES: c1(cc2ccccc2cc1)C(=O)NC(N(CC)CC)=[Se]
• Title of publication: A Single-Source Precursor Route to Unusual PbSe Nanostructures by a Solution-Liquid-Solid Method
• Authors of publication: Javeed Akhtar; Masood Akhtar; Mohammad Azad Malik; Paul O'Brien; James Raftery
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 2485 - 2487
• a: 11.1943 ± 0.0008 Å
• b: 11.267 ± 0.0008 Å
• c: 13.5411 ± 0.001 Å
• α: 72.63 ± 0.001°
• β: 85.297 ± 0.001°
• γ: 66.5 ± 0.001°
• Cell volume: 1493.47 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0477
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No