Information card for entry 1556689

Structure parameters

• Formula: C22 H40 I16 N8
• Calculated formula: C22 H40 I16 N8
• Title of publication: Stabilization of Supramolecular Networks of Polyiodides with Protonated Small Tetra-azacyclophanes
• Authors of publication: Savastano, M.; Martinez-Camarena, A.; Bazzicalupi, C.; Delgado-Pinar, E.; Llinares, J.M.; Mariani, P.; Verdejo, B.; Garcia-Espana, E.; Bianchi, A.
• Journal of publication: Inorganics
• Year of publication: 2019
• Journal volume: 7
• Pages of publication: 48
• a: 8.3 ± 0.001 Å
• b: 16.191 ± 0.002 Å
• c: 21.221 ± 0.003 Å
• α: 108.167 ± 0.004°
• β: 94.071 ± 0.005°
• γ: 104.453 ± 0.004°
• Cell volume: 2589.3 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.106
• Weighted residual factors for all reflections included in the refinement: 0.1083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No