Information card for entry 7124516

Structure parameters

• Formula: C41 H46 Cu F6 N6 P
• Calculated formula: C41 H46 Cu F6 N6 P
• Title of publication: Highly sensitive mechano-controlled luminescence in polymer films modified by dynamic Cu^I-based cross-linkers.
• Authors of publication: Karimata, Ayumu; Patil, Pradnya H.; Khaskin, Eugene; Lapointe, Sébastien; Fayzullin, Robert R.; Stampoulis, Pavlos; Khusnutdinova, Julia R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 1
• Pages of publication: 50 - 53
• a: 10.8787 ± 0.0002 Å
• b: 19.7204 ± 0.0004 Å
• c: 18.0429 ± 0.0004 Å
• α: 90°
• β: 94.732 ± 0.002°
• γ: 90°
• Cell volume: 3857.59 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0421
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.1069
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No