Geometry & MOs

Info

ID:	241845
PubChem CID:	96024388
Reduced:	ClNC18H20 (1)
Stoich.:	ABC18D20 (1)
Weight, g/mol:	285.128427
ΔH_f, kcal/mol:	12.89
Dipole, Da:	3.15
IP(EA), eV:	-8.82(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(2-chloro-6-methylphenyl)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)Cl)[C@H]2C3=C(CCN2)C=CC(=C3C)C

DOS

IR

Vibrations