| Literature DB >> 27774554 |
Juan P Marcolongo1, Uriel N Morzan, Ari Zeida, Damián A Scherlis, José A Olabe.
Abstract
Nitrosodisulfide S2NO- is a controversial intermediate in the reactions of S-nitrosothiols with HS- that produce NO and HNO. QM-MM molecular dynamics simulations combined with TD-DFT analysis contribute to a clear identification of S2NO- in water, acetone and acetonitrile, accounting for the UV-Vis signatures and broadening the mechanistic picture of N/S signaling in biochemistry.Entities:
Year: 2016 PMID: 27774554 DOI: 10.1039/c6cp06314d
Source DB: PubMed Journal: Phys Chem Chem Phys ISSN: 1463-9076 Impact factor: 3.676