Geometry & MOs

Info

ID:	27645
PubChem CID:	822784
Reduced:	N2O2C21H24 (1)
Stoich.:	A2B2C21D24 (1)
Weight, g/mol:	338.163043
ΔH_f, kcal/mol:	-48.13
Dipole, Da:	2.88
IP(EA), eV:	-8.15(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(cyanomethyl)phenyl]-2-(3,4-diethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)N2C3=C(C=C(C=C3)OC)C(=CC2(C)C)C

DOS

IR

Vibrations