Geometry & MOs

Info

ID:	242091
PubChem CID:	96025710
Reduced:	NOC18H21 (1)
Stoich.:	ABC18D21 (1)
Weight, g/mol:	291.1987
ΔH_f, kcal/mol:	-23.3
Dipole, Da:	0.79
IP(EA), eV:	-8.79(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-5,8-dimethyl-1-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=C2CCN[C@H](C2=C(C=C1)C)C3=C(C(=CC=C3)O)C

DOS

IR

Vibrations