Geometry & MOs

Info

ID:	196693
PubChem CID:	78865956
Reduced:	FON4C21H21 (1)
Stoich.:	ABC4D21E21 (1)
Weight, g/mol:	350.163043
ΔH_f, kcal/mol:	9.92
Dipole, Da:	6.39
IP(EA), eV:	-8.7(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-7-methoxy-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)CCNC(=O)C3=NN(C=C3)C4=CC=CC=C4F

DOS

IR

Vibrations