Geometry & MOs

Info

ID:	166156
PubChem CID:	74642726
Reduced:	N2O2C21H24 (1)
Stoich.:	A2B2C21D24 (1)
Weight, g/mol:	366.194343
ΔH_f, kcal/mol:	-27.4
Dipole, Da:	3.94
IP(EA), eV:	-8.08(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,4-dimethoxyphenyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]prop-2-enamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C=CC(=O)NCC2=CC=C(C=C2)N3CCCC3

DOS

IR

Vibrations