Information card for entry 7239224

Structure parameters

• Common name: coanp
• Chemical name: 2-(Cyclo-octylamino)-5-nitropyridine
• Formula: C13 H19 N3 O2
• Calculated formula: C13 H19 N3 O2
• Title of publication: Molecular recognition at growing crystal faces revealed by phase sensitive second harmonic microscopy
• Authors of publication: Aboulfadl, Hanane; Bonin, Michel; Burgner, Matthias; Brahimi, Khadidja; Hulliger, Jürg
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 47
• Pages of publication: 25145
• a: 26.01 ± 0.005 Å
• b: 6.636 ± 0.0013 Å
• c: 7.5136 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1296.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0325
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0814
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No