Geometry & MOs

Info

ID:	61121
PubChem CID:	26705848
Reduced:	O2N4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	4.2
Dipole, Da:	4.67
IP(EA), eV:	-8.12(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]amino]phenyl]-2-methylpropanamide

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)/C=C/C2=CN(N=C2)CC3=CC=CC=C3

DOS

IR

Vibrations