Information card for entry 7035011

Structure parameters

• Formula: C41 H26 Cu F26 N2 O3 P3
• Calculated formula: C41 H22 Cu F26 N2 O3 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]1ccc(OC)cc1c1[n]2ccc(OC)c1.[P](F)(F)(F)(F)(F)[F-].O=C(C)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: 13.29 ± 0.005 Å
• b: 19.92 ± 0.006 Å
• c: 20.107 ± 0.005 Å
• α: 90°
• β: 122.495 ± 0.016°
• γ: 90°
• Cell volume: 4490 ± 3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• 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: 0.0616
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.194
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No