Geometry & MOs

Info

ID:	241168
PubChem CID:	96021656
Reduced:	NOC18H21 (1)
Stoich.:	ABC18D21 (1)
Weight, g/mol:	267.162314
ΔH_f, kcal/mol:	-13.83
Dipole, Da:	2.63
IP(EA), eV:	-8.38(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(5-methoxy-2-methylphenyl)-6-methyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=C2[C@@H](NCCC2=CC=C1)C3=C(C=CC(=C3)OC)C

DOS

IR

Vibrations