Information card for entry 7045334

Structure parameters

• Chemical name: bis[(Naphthalen-1-ylmethyl)di(pyridin-2-yl)phosphine oxide]-bis(m2-iodo)-di-copper
• Formula: C42 H34 Cu2 I2 N4 O2 P2
• Calculated formula: C42 H34 Cu2 I2 N4 O2 P2
• Title of publication: Bright green-to-yellow emitting Cu(i) complexes based on bis(2-pyridyl)phosphine oxides: synthesis, structure and effective thermally activated-delayed fluorescence.
• Authors of publication: Artem'ev, Alexander V.; Ryzhikov, Maxim R.; Taidakov, Ilya V.; Rakhmanova, Mariana I.; Varaksina, Evgenia A.; Bagryanskaya, Irina Yu; Malysheva, Svetlana F.; Belogorlova, Nataliya A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 8
• Pages of publication: 2701 - 2710
• a: 12.842 ± 0.0009 Å
• b: 19.17 ± 0.0012 Å
• c: 20.167 ± 0.0013 Å
• α: 111.493 ± 0.003°
• β: 94.25 ± 0.003°
• γ: 108.188 ± 0.003°
• Cell volume: 4287.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1673
• Residual factor for significantly intense reflections: 0.0873
• Weighted residual factors for significantly intense reflections: 0.1821
• Weighted residual factors for all reflections included in the refinement: 0.2381
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No