Information card for entry 1550351

Structure parameters

• Formula: C26 H28 N6 O4 S2
• Calculated formula: C26 H28 N6 O4 S2
• SMILES: S(=O)(C)C.S(=O)(C)C.O=C(Nc1ccncc1)c1cc(ncc1)c1nccc(c1)C(=O)Nc1ccncc1
• Title of publication: Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation.
• Authors of publication: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti
• Journal of publication: Soft matter
• Year of publication: 2019
• Journal volume: 15
• Journal issue: 3
• Pages of publication: 442 - 451
• a: 7.4404 ± 0.0005 Å
• b: 9.0236 ± 0.0007 Å
• c: 10.0764 ± 0.0007 Å
• α: 89.276 ± 0.006°
• β: 72.988 ± 0.006°
• γ: 79.287 ± 0.006°
• Cell volume: 635.02 ± 0.08 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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 all reflections: 0.0367
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No