Information card for entry 7035012

Structure parameters

• Formula: C41 H23 Cu F26 N2 P3
• Calculated formula: C41 H23 Cu F26 N2 P3
• SMILES: [Cu]12([P](c3c(F)c(F)c(F)c(F)c3F)(c3c(F)c(F)c(F)c(F)c3F)CC[P]1(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)[n]1cc(ccc1c1[n]2cc(cc1)C)C.[P](F)(F)(F)(F)(F)[F-].C(CCCC)C
• Title of publication: Long-lived and oxygen-responsive photoluminescence in the solid state of copper(i) complexes bearing fluorinated diphosphine and bipyridine ligands.
• Authors of publication: Nishikawa, Michihiro; Wakita, Yuri; Nishi, Tatsuya; Miura, Takumi; Tsubomura, Taro
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 19
• Pages of publication: 9170 - 9181
• a: 11.5047 ± 0.001 Å
• b: 33.521 ± 0.003 Å
• c: 23.333 ± 0.002 Å
• α: 90°
• β: 98.828 ± 0.001°
• γ: 90°
• Cell volume: 8891.8 ± 1.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0982
• Residual factor for significantly intense reflections: 0.0828
• Weighted residual factors for all reflections included in the refinement: 0.1599
• Goodness-of-fit parameter for all reflections included in the refinement: 1.198
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No