Geometry & MOs

Info

ID:	138716
PubChem CID:	52415055
Reduced:	SN3O4C21H27 (1)
Stoich.:	AB3C4D21E27 (1)
Weight, g/mol:	384.204907
ΔH_f, kcal/mol:	-119.43
Dipole, Da:	4.02
IP(EA), eV:	-8.61(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-N-[3-(4-methoxyphenyl)propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations