Information card for entry 7249475

Structure parameters

• Formula: C44 H64 N10 O8 Zn
• Calculated formula: C44 H64 N10 O8 Zn
• Title of publication: Self-assembly properties of zinc(ii) complexes with azo ligands grafted with dodecyl chains: towards supramolecular materials driven by coordination and hydrophobic effect
• Authors of publication: Gak Simić, Kristina; Đorđević, Ivana; Mašulović, Aleksandra; Radovanović, Lidija; Jeannin, Olivier; Camerel, Franck; Trišović, Nemanja
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 45
• Pages of publication: 6448 - 6464
• a: 15.459 ± 0.002 Å
• b: 10.6509 ± 0.0013 Å
• c: 30.001 ± 0.004 Å
• α: 90°
• β: 103.017 ± 0.006°
• γ: 90°
• Cell volume: 4812.8 ± 1.1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0751
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.1695
• Weighted residual factors for all reflections included in the refinement: 0.1788
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No