Information card for entry 2004142

Structure parameters

• Formula: C17 H19 N3 O
• Calculated formula: C17 H19 N3 O
• SMILES: c1ccc(cc1)N/C(=N\c1ccccc1)N1CCOCC1
• Title of publication: 3,3-(Oxydiethyl)-1,2-diphenylguanidine
• Authors of publication: Sudha, L.; Senthil Selvan, J.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 11
• Pages of publication: 2329 - 2331
• a: 9.211 ± 0.004 Å
• b: 14.671 ± 0.004 Å
• c: 11.533 ± 0.004 Å
• α: 90°
• β: 111.14 ± 0.04°
• γ: 90°
• Cell volume: 1453.6 ± 1 ų
• Cell temperature: 294 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 significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.065
• Goodness-of-fit parameter for significantly intense reflections: 1.26
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No