Characterization of N⋯O non-covalent interactions involving σ-holes: "Electrostatics" or "dispersion"

Keyphrases

• Noncovalent Interactions 100%
• O Atom 100%
• Halo 50%
• Charge Transfer 50%
• Ammonia Water 50%
• Topological Data Analysis 50%
• Geometry Optimization 50%
• Major Contributor 50%
• Electrostatic Energy 50%
• Main Charge 50%
• N Atoms 50%
• Hole Interaction 50%
• Bond Critical Point 50%
• Water Complexes 50%
• NBO Analysis 50%
• Aug-cc-pVTZ 50%
• Chlorine Substitution 50%
• Binding Energy Calculations 50%
• Energy Decomposition Analysis 50%
• Pnicogen Bond 50%

Chemistry

• Binding Energy 100%
• Møller-Plesset Perturbation Theory 100%
• Non-Covalent Interactions 100%