Geometry & MOs

Info

ID:	241141
PubChem CID:	96021494
Reduced:	NC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	190.146999
ΔH_f, kcal/mol:	8.48
Dipole, Da:	1.84
IP(EA), eV:	-8.78(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[(1S)-8-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations