Geometry & MOs

Info

ID:	242085
PubChem CID:	96025655
Reduced:	NC8H12 (2)
Stoich.:	AB8C12 (2)
Weight, g/mol:	290.178299
ΔH_f, kcal/mol:	-2.82
Dipole, Da:	1.46
IP(EA), eV:	-8.36(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-5,8-dimethyl-1-(5-methyl-1H-indol-2-yl)-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=C2CCN[C@H](C2=C(C=C1)C)[C@H]3CCCCN3

DOS

IR

Vibrations