Information card for entry 7153056

Structure parameters

• Formula: C35 H32 Cu F6 I N3 P
• Calculated formula: C35 H32 Cu F6 I N3 P
• Title of publication: Merging strong and weak coordination motifs in the integrative self-sorting of a 5-component trapezoid and scalene triangle.
• Authors of publication: Saha, Manik Lal; Bats, Jan W.; Schmittel, Michael
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2013
• Journal volume: 11
• Journal issue: 34
• Pages of publication: 5592 - 5595
• a: 11.8031 ± 0.0006 Å
• b: 12.1213 ± 0.0006 Å
• c: 14.0357 ± 0.0007 Å
• α: 91.493 ± 0.001°
• β: 113.899 ± 0.001°
• γ: 111.558 ± 0.001°
• Cell volume: 1670.96 ± 0.15 ų
• Cell temperature: 171 ± 2 K
• Ambient diffraction temperature: 171 ± 2 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: 0.0431
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.071
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No