Geometry & MOs

Info

ID:	241679
PubChem CID:	96023992
Reduced:	NOC19H23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	-24.63
Dipole, Da:	2.46
IP(EA), eV:	-8.86(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)[C@H](NCC2)[C@@H](CO)C3=CC=CC=C3

DOS

IR

Vibrations