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. 2019 May 9;6(Pt 4):603–609. doi: 10.1107/S2052252519004706

Table 5. Electronic excitation energies (λ), oscillator strengths (f), corresponding compositions and the configuration interactions (CI) for t-C5-PyDI in gas and in cyclo­hexane.

  Transition λ(nm) f Composition CI (%)
t-C5-PyDI (gas) S 0S 1 383 0.201 H→L 91
S 0S 10 268 0.471 H→L + 2 79
t-C5-PyDI (cyclo­hexane) S 0S 1 392 0.287 H→L 100
S 0S 3 350 0.129 H − 1→L 85
S 0S 9 271 0.595 H→L + 2 82