Information card for entry 7041865

Structure parameters

• Formula: C36 H26 N2 O2 P2
• Calculated formula: C36 H26 N2 O2 P2
• SMILES: P(=O)(c1ccccc1)(c1ccccc1)c1nc2c(cc1)ccc1c2nc(P(=O)(c2ccccc2)c2ccccc2)cc1
• Title of publication: Hard-and-soft phosphinoxide receptors for f-element binding: structure and photophysical properties of europium(iii) complexes.
• Authors of publication: Borisova, Nataliya E.; Kharcheva, Anastasia V.; Patsaeva, Svetlana V.; Korotkov, Leonid A.; Bakaev, Sergey; Reshetova, Marina D.; Lyssenko, Konstantin A.; Belova, Elena V.; Myasoedov, Boris F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 7
• Pages of publication: 2238 - 2248
• a: 8.5375 ± 0.0011 Å
• b: 12.2811 ± 0.0016 Å
• c: 15.439 ± 0.002 Å
• α: 69.8 ± 0.003°
• β: 84.355 ± 0.003°
• γ: 84.962 ± 0.003°
• Cell volume: 1509.3 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1998
• Residual factor for significantly intense reflections: 0.0738
• Weighted residual factors for significantly intense reflections: 0.1568
• Weighted residual factors for all reflections included in the refinement: 0.2189
• Goodness-of-fit parameter for all reflections included in the refinement: 0.872
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No