Information card for entry 2013281

Structure parameters

• Formula: C14 H26 N8 O2
• Calculated formula: C14 H26 N8 O2
• SMILES: O=C(N[C@H](CN=N#N)CC(C)C)C(=O)N[C@@H](CC(C)C)CN=N#N
• Title of publication: Hydrogen bonding in <i>N</i>,<i>N</i>'-bis[(1<i>S</i>)-2-azido-1-(2-methylpropyl)ethyl]oxalamide: twofold symmetry of <i>R</i>f̱{_2^2}(10) hydrogen-bonded dimers connected into an α-network
• Authors of publication: Zoran Štefanić; Biserka Kojić-Prodić; Zoran Džolić; Darinka Katalenić; Mladen Žinić; Anton Meden
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 6
• Pages of publication: o286 - o288
• a: 24.0235 ± 0.0005 Å
• b: 7.9361 ± 0.0002 Å
• c: 20.2167 ± 0.0005 Å
• α: 90°
• β: 107.824 ± 0.001°
• γ: 90°
• Cell volume: 3669.37 ± 0.15 ų
• Cell temperature: 150 ± 1 K
• Number of distinct elements: 4
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for all reflections included in the refinement: 0.1287
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes