Geometry & MOs

Info

ID:	241872
PubChem CID:	96024452
Reduced:	NC10H11 (2)
Stoich.:	AB10C11 (2)
Weight, g/mol:	292.193949
ΔH_f, kcal/mol:	34.85
Dipole, Da:	1.79
IP(EA), eV:	-8.37(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-7,8-dimethyl-1-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(=C2)[C@H]3C4=C(CCN3)C=CC(=C4C)C

DOS

IR

Vibrations