Information card for entry 1541909

Structure parameters

• Formula: C50.5 H79.5 N2.5 O9.5
• Calculated formula: C50.5 H79.5 N2.5 O9.5
• SMILES: O(C(=O)CCCCCCCCCCCCCCC)[C@H]1[C@@H](OC(=O)CCCCCCCCCCCCCCC)[C@@H](O[C@@H]1N1C=C(C(=O)NC1=O)c1oc2ccccc2c1)CO.N(C)(C=O)C
• Title of publication: Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs.
• Authors of publication: Nuthanakanti, Ashok; Srivatsan, Seergazhi G.
• Journal of publication: Nanoscale
• Year of publication: 2016
• Journal volume: 8
• Journal issue: 6
• Pages of publication: 3607 - 3619
• a: 8.671 ± 0.007 Å
• b: 11.183 ± 0.009 Å
• c: 27.36 ± 0.02 Å
• α: 94.389 ± 0.014°
• β: 97.977 ± 0.016°
• γ: 109.553 ± 0.014°
• Cell volume: 2454 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.2949
• Residual factor for significantly intense reflections: 0.0725
• Weighted residual factors for significantly intense reflections: 0.1467
• Weighted residual factors for all reflections included in the refinement: 0.2409
• Goodness-of-fit parameter for all reflections included in the refinement: 0.643
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No