Geometry & MOs

Info

ID:	202771
PubChem CID:	79723684
Reduced:	N4C17H18 (1)
Stoich.:	A4B17C18 (1)
Weight, g/mol:	279.162314
ΔH_f, kcal/mol:	53.41
Dipole, Da:	1.99
IP(EA), eV:	-8.52(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6,7,8-tetrahydroquinolin-8-yl)-3,4-dihydro-1H-naphthalen-2-ol

Drug info:

PubChemData

Smile

CC1=CC(=NC(=C1C#N)NC2CCC3=C2C=CC(=C3)N)C

DOS

IR

Vibrations