Information card for entry 1507291

Structure parameters

• Formula: C11 H16 Cl N3 O
• Calculated formula: C11 H16 Cl N3 O
• Title of publication: First practical synthesis of formamidine ureas and derivatives.
• Authors of publication: Ripka, Amy S.; Díaz, David D; Sharpless, K. Barry; Finn, M. G.
• Journal of publication: Organic letters
• Year of publication: 2003
• Journal volume: 5
• Journal issue: 9
• Pages of publication: 1531 - 1533
• a: 10.496 ± 0.006 Å
• b: 13.985 ± 0.006 Å
• c: 9.237 ± 0.005 Å
• α: 106.79 ± 0.04°
• β: 94.99 ± 0.05°
• γ: 84.92 ± 0.04°
• Cell volume: 1290.3 ± 1.2 ų
• Cell temperature: 173.2 K
• Ambient diffraction temperature: 173.2 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 significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.062
• Goodness-of-fit parameter for significantly intense reflections: 1.608
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No