Information card for entry 1558745

Structure parameters

• Formula: C23 H31 N3 O4
• Calculated formula: C23 H31 N3 O4
• Title of publication: Excited State Electron Transfer from Donor−π System‒Acceptor Dyes to ZnO Nanocrystals
• Authors of publication: Swedin, Rachel; Badgurjar, Deepak; Healy, Andrew; Harkins, Robin; Oehrlein, Amanda; Greenlund, Lindsey; Alshebber, Mohammed; Ripp, Nathan; Anderson, Nathaniel T.; Honzay, Benjamin R.; Pappenfus, Ted M.; Janzen, Daron E.; Blank, David A.; Gladfelter, Wayne L.
• Journal of publication: The Journal of Physical Chemistry C
• Year of publication: 2020
• Journal volume: 124
• Journal issue: 28
• Pages of publication: 15565 - 15573
• a: 10.072 ± 0.003 Å
• b: 10.703 ± 0.004 Å
• c: 41.298 ± 0.013 Å
• α: 90°
• β: 90.973 ± 0.01°
• γ: 90°
• Cell volume: 4451 ± 3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for significantly intense reflections: 0.0698
• Weighted residual factors for all reflections included in the refinement: 0.1865
• Goodness-of-fit parameter for all reflections included in the refinement: 0.974
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No