Non-covalent Interactions Flashcards
What are the three types of electrostatic interactions
ion-ion
ion-dipole
dipole-dipole
Ion-ion energy?
100-350 kj/mol
Ion dipole arrangement and energy?
Ion brings itself into line with oppositely charged dipole (50-200 kj/mol)
What is a hydrogen bond?
Hydrogen atom covalently bonded to an electronegative atom which is attracted to a neighbouring dipole
Hydrogen bond energy?
4-60 kj/mol
Relative strength of hydrogen bonds?
Weaker than covalent bonds
If many they are highly strong due to directional nature
What is halogen bonding?
Arise from appearance of sigma-hole at X. Electron density can be donated into this
What are the types of pi-pi interactions?
Face to face
Face to edge
Why can anion-pi interactions happen?
There is a charge difference between anion and neutral benzene
What are the properties of dispersion forces?
Very general and weak (2 kJ/mol), lack directionality
Why is steric repulsion important?
Achieving selectivity
What are the stages of complexation?
Desolvation of anion and receptor
Binding of anion
Resolvation of host-guest complex
What is key in complexation?
Thermodynamics - negative enthalpy and positive entropy is favourable, so gibbs free energy is negative and spontaneous
What is the hydrophobic effect?
In a hydrophobic pocket, water molecules hydrogen bond to each other. Addition of guest leads to the release of these water molecules
What is the enthalpy and entropy of the hydrophobic effect?
Enthalpy is negative - stronger non-covalent interactions have formed
Entropy is positive - release of molecules, increase in disorder