Geometry & MOs

Info

ID:	241158
PubChem CID:	96021575
Reduced:	ON2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	271.112777
ΔH_f, kcal/mol:	-50.57
Dipole, Da:	4.86
IP(EA), eV:	-9.0(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)[C@@H](NCC2)[C@H](C)NC(=O)C

DOS

IR

Vibrations