Geometry & MOs

Info

ID:	241769
PubChem CID:	96024199
Reduced:	NC10H10 (2)
Stoich.:	AB10C10 (2)
Weight, g/mol:	290.178299
ΔH_f, kcal/mol:	51.91
Dipole, Da:	4.46
IP(EA), eV:	-8.93(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(1H-indol-3-ylmethyl)-7,8-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)[C@H](NCC2)C3=CC4=CC=CC=C4N=C3

DOS

IR

Vibrations