Information card for entry 7224257

Structure parameters

• Formula: C33.42 H35.65 N6.81 O5.81 Zn
• Calculated formula: C33.421 H35.649 N6.807 O5.807 Zn
• Title of publication: Coordination networks incorporating halogen-bond donor sites and azobenzene groups
• Authors of publication: Fernandez-Palacio, Francisco; Saccone, Marco; Priimagi, Arri; Terraneo, Giancarlo; Pilati, Tullio; Metrangolo, Pierangelo; Resnati, Giuseppe
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 13
• Pages of publication: 2251
• a: 10.1389 ± 0.0005 Å
• b: 14.9139 ± 0.0008 Å
• c: 23.1236 ± 0.0012 Å
• α: 90°
• β: 95.194 ± 0.002°
• γ: 90°
• Cell volume: 3482.2 ± 0.3 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1145
• Residual factor for significantly intense reflections: 0.0789
• Weighted residual factors for significantly intense reflections: 0.2271
• Weighted residual factors for all reflections included in the refinement: 0.2566
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No