Information card for entry 1556272

Structure parameters

• Formula: C18 H22 N O5 P
• Calculated formula: C18 H22 N O5 P
• SMILES: P(=O)(OCC)(OCC)C(Nc1ccccc1)c1cc2OCOc2cc1
• Title of publication: Application of mobilized Cu-nanoparticles as heterogeneous catalyst for the synthesis of α-amino phosphonates via A2-P coupling
• Authors of publication: Kidwai, Mazaahir; Bhardwaj, Saurav; Mishra, Neeraj Kumar; Jain, Arti; Kumar, Ajeet; Mozzumdar, Subho
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2011
• Journal volume: 1
• Journal issue: 3
• Pages of publication: 426
• a: 22.1091 ± 0.0011 Å
• b: 10.4184 ± 0.0003 Å
• c: 18.2639 ± 0.0008 Å
• α: 90°
• β: 118.495 ± 0.006°
• γ: 90°
• Cell volume: 3697.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1878
• Residual factor for significantly intense reflections: 0.1463
• Weighted residual factors for significantly intense reflections: 0.3717
• Weighted residual factors for all reflections included in the refinement: 0.4034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.428
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No