Information card for entry 4349411

Structure parameters

• Chemical name: 3,7-dimethyl-2,4,6,8-tetraphenyl-1,5,3,7,2,4,6,8-dithiadiazatetraphosphocane
• Formula: C26 H26 N2 P4 S2
• Calculated formula: C26 H26 N2 P4 S2
• Title of publication: Nitrogen-Phosphorus(III)-Chalcogen Macrocycles for the Synthesis of Polynuclear Silver(I) Sandwich Complexes.
• Authors of publication: Yogendra, Sivathmeehan; Hennersdorf, Felix; Weigand, Jan J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 15
• Pages of publication: 8698 - 8704
• a: 11.08745 ± 0.00009 Å
• b: 11.01972 ± 0.00007 Å
• c: 11.82438 ± 0.0001 Å
• α: 90°
• β: 113.092 ± 0.001°
• γ: 90°
• Cell volume: 1328.95 ± 0.02 ų
• Cell temperature: 99.98 ± 0.13 K
• Ambient diffraction temperature: 99.98 ± 0.13 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0275
• Residual factor for significantly intense reflections: 0.0274
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.0779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No