Geometry & MOs

Info

ID:	138371
PubChem CID:	52356960
Reduced:	FNO4C20H24 (1)
Stoich.:	ABC4D20E24 (1)
Weight, g/mol:	384.204907
ΔH_f, kcal/mol:	-164.07
Dipole, Da:	6.55
IP(EA), eV:	-8.51(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-methyl-N-[(1R)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

COC1=C2CN(C[C@@H](C2=C(C=C1)OC)O)CCCOC3=CC=C(C=C3)F

DOS

IR

Vibrations