Halogen bond in (CH3)(n)X (X = N, P, n = 3; X = S, n = 2) and (CH3)(n)XO (X = N, P, n = 3; X = S, n = 2) adducts with CF3I. Structural and energy analysis including relativistic zero-order regular approximation approach in a density functional theory fram

TitleHalogen bond in (CH3)(n)X (X = N, P, n = 3; X = S, n = 2) and (CH3)(n)XO (X = N, P, n = 3; X = S, n = 2) adducts with CF3I. Structural and energy analysis including relativistic zero-order regular approximation approach in a density functional theory fram
Publication TypeJournal Article
Year of Publication2002
Romaniello, P, Lelj, F
JournalJOURNAL OF PHYSICAL CHEMISTRY A
Volume106
Issue39
Pagination9114-9119
Date PublishedOCT 3
Keywordspaper
Abstract

{Density functional theory (DFT) calculations on the geometry and bonding energy of the X- - -1 intermolecular interaction of CF3I and (CH3)(n)X (X = N, P

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