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Topological (ELF and ρ) study of the unusually long N–O bond in (CF3)2NO–NO.

Autorzy

Sławomir Berski

Agnieszka J. Gordon

Rok wydania

2012

Czasopismo

Chemical Physics Letters

Numer woluminu

525-526

Strony

24-31

DOI

10.1016/j.cplett.2011.12.035

Kolekcja

Naukowa

Język

Angielski

Typ publikacji

Artykuł

Streszczenie

Our previous studies revealed three different types of N–O bonding: the ‘normal’ covalent bond, characterized by the bonding V(N,O) basin, the protocovalent bond, characterized by two non-bonding basins, V(N), V(O), and a bond characterized by a non-bonding basin, V(N). The results suggest that the formally single N–O bond, containing no ELF-basins, is possible. Our study confirms its existence in the (CF3)2NO–NO molecule.

Adres publiczny

http://dx.doi.org/10.1016/j.cplett.2011.12.035

Strona internetowa wydawcy

http://www.elsevier.com

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