Geometry & MOs

Info

ID:	241167
PubChem CID:	96021652
Reduced:	FNC18H20 (1)
Stoich.:	ABC18D20 (1)
Weight, g/mol:	267.162314
ΔH_f, kcal/mol:	-22.38
Dipole, Da:	2.22
IP(EA), eV:	-9.07(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(5-methoxy-2-methylphenyl)-8-methyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=C2[C@@H](NCCC2=CC=C1)CCC3=CC=CC=C3F

DOS

IR

Vibrations