Information card for entry 7245553

Structure parameters

• Formula: C81 H56 Cu2 F24 N6 O12
• Calculated formula: C81 H56 Cu2 F24 N6 O12
• 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: 8.93 ± 0.0002 Å
• b: 15.7218 ± 0.0003 Å
• c: 16.4219 ± 0.0003 Å
• α: 100.03 ± 0.0015°
• β: 93.7146 ± 0.0016°
• γ: 96.8981 ± 0.0018°
• Cell volume: 2245.21 ± 0.08 ų
• Cell temperature: 160 ± 0.1 K
• Ambient diffraction temperature: 160 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.083
• Residual factor for significantly intense reflections: 0.0758
• Weighted residual factors for significantly intense reflections: 0.2299
• Weighted residual factors for all reflections included in the refinement: 0.2463
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No