Geometry & MOs

Info

ID:	241889
PubChem CID:	96024507
Reduced:	N2C19H24 (1)
Stoich.:	A2B19C24 (1)
Weight, g/mol:	280.193949
ΔH_f, kcal/mol:	31.32
Dipole, Da:	2.3
IP(EA), eV:	-8.76(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-1-[(1S)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methanamine

Drug info:

PubChemData

Smile

CC1=C(C2=C(CCN[C@H]2CNCC3=CC=CC=C3)C=C1)C

DOS

IR

Vibrations