Information card for entry 7710223

Structure parameters

• Common name: 14
• Formula: C62 H44 Cl12 Hg2 I6 N2 P2 Si2 Zn
• Calculated formula: C60 H42 Cl6 Hg2 I6 N2 P2 Si2 Zn
• Title of publication: Phosphorus or nitrogen – the first phosphatriptycene in coordination polymer chemistry
• Authors of publication: Gildenast, Hans; Gruszien, Lukas; Friedt, Felix; Englert, Ulli
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 18.813 ± 0.004 Å
• b: 15.236 ± 0.004 Å
• c: 28.871 ± 0.007 Å
• α: 90°
• β: 108.057 ± 0.004°
• γ: 90°
• Cell volume: 7868 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0524
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0756
• Weighted residual factors for all reflections included in the refinement: 0.0833
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No