Hydrogen Bond versus Polar Effects: An Ab Initio Analysis on n → π* Absorption Spectra and N Nuclear Shieldings of Diazines in Solution
Author:
Affiliation:
1. Contribution from the Dipartimento di Chimica e Chimica Industriale, Università di Pisa, via Risorgimento 35, 56126 Pisa, Italy
Publisher
American Chemical Society (ACS)
Subject
Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis
Link
https://pubs.acs.org/doi/pdf/10.1021/ja0118542
Reference49 articles.
1. Solvent Effects on the Fluorescence Spectra of Diazines. Dipole Moments in the (n,π*) Excited States1
2. The Rôle of Hydrogen Bonding in the n → π* Blue-shift Phenomenon1
3. Protonation Effects on n → π* Transitions in Pyrimidine1
4. Solvent effects on molecular spectra. I. Normal pressure and temperature Monte Carlo simulations of the structure of dilute pyrimidine in water
5. Solvent Effects on Molecular and Ionic Spectra. VIII. The 1(n,π*) Excited States of Pyridazine in Water
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