Information card for entry 7124517

Structure parameters

• Formula: C37 H38 Cu F6 N6 P
• Calculated formula: C37 H38 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: 15.83319 ± 0.00017 Å
• b: 17.71151 ± 0.00019 Å
• c: 12.63601 ± 0.00015 Å
• α: 90°
• β: 97.3523 ± 0.001°
• γ: 90°
• Cell volume: 3514.38 ± 0.07 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0376
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0813
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No