Geometry & MOs

Info

ID:	39334
PubChem CID:	8140314
Reduced:	ClN2O2C18H21 (1)
Stoich.:	AB2C2D18E21 (1)
Weight, g/mol:	368.209993
ΔH_f, kcal/mol:	-45.34
Dipole, Da:	4.87
IP(EA), eV:	-8.95(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[[2-[(dimethylamino)methyl]phenyl]methyl]-3-(3-ethoxy-4-methoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)C2=C(C=CC(=C2)Cl)OC

DOS

IR

Vibrations