Geometry & MOs

Info

ID:	268202
PubChem CID:	103598348
Reduced:	O2N4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	349.179027
ΔH_f, kcal/mol:	-24.16
Dipole, Da:	6.44
IP(EA), eV:	-8.86(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-benzofuran-2-yl)-N-[2-(dimethylamino)ethyl]-N-(pyridin-3-ylmethyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C=CC(=O)N(CCN(C)C)CC2=CN=CC=C2

DOS

IR

Vibrations