DOI: 10.1039/d6cp02233b ISSN: 1463-9076
Electronic structure and spectroscopic properties of astrochemically relevant C n HN isomers
Lisset Noriega, Lenin J. Díaz Soto, Ricardo R. Oliveira, Luis Armando Gonzalez-Ortiz, Gabriel Merino, Marco Antonio Chaer NascimentoQuantum-chemical study of 21 low-energy neutral singlet and triplet C n HN ( n = 2–5) isomers reveals mostly linear or quasi-linear minima, except for C 4 HN, and identifies a new C 5 HN isomer.