Geometry & MOs

Info

ID:	241776
PubChem CID:	96024232
Reduced:	NC7H11 (2)
Stoich.:	AB7C11 (2)
Weight, g/mol:	218.178299
ΔH_f, kcal/mol:	-0.92
Dipole, Da:	3.04
IP(EA), eV:	-8.45(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C2=C(CCN[C@H]2[C@H](C)NC)C=C1)C

DOS

IR

Vibrations