Information card for entry 7211676

Structure parameters

• Formula: C26 H23 N9 O4
• Calculated formula: C26 H23 N9 O4
• SMILES: c12c(cccc1cccc2)N=Nc1ncc[nH]1.c12c(cccc1cccc2)N=Nc1[nH]cc[nH+]1.O.O=N(=O)[O-]
• Title of publication: Aryl azo imidazoles assisted assembly of anion/anion‒water through salt formation
• Authors of publication: Pramanik, Avijit; Majumdar, Subhojit; Das, Gopal
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 1
• Pages of publication: 250
• a: 5.6061 ± 0.0002 Å
• b: 15.8135 ± 0.0006 Å
• c: 14.0347 ± 0.0005 Å
• α: 90°
• β: 97.281 ± 0.002°
• γ: 90°
• Cell volume: 1234.17 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.083
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.1135
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No