Information card for entry 7245556

Structure parameters

• Formula: C86.4 H56.4 Cl5.2 Cu2 F24 N6 O10.5
• Calculated formula: C86.4 H56.4 Cl5.2 Cu2 F24 N6 O10.5
• Title of publication: Multitopic 3,2':6',3''-terpyridine ligands as 4-connecting nodes in two-dimensional 4,4-networks
• Authors of publication: Manfroni, Giacomo; Spingler, Bernhard; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 9.0105 ± 0.0003 Å
• b: 15.1823 ± 0.0004 Å
• c: 19.9645 ± 0.0003 Å
• α: 109.391 ± 0.002°
• β: 92.202 ± 0.002°
• γ: 100.595 ± 0.002°
• Cell volume: 2517.69 ± 0.12 ų
• Cell temperature: 160 ± 0.1 K
• Ambient diffraction temperature: 160 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1225
• Residual factor for significantly intense reflections: 0.0984
• Weighted residual factors for significantly intense reflections: 0.2869
• Weighted residual factors for all reflections included in the refinement: 0.3162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.209
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No