Geometry & MOs

Info

ID:	343388
PubChem CID:	127266561
Reduced:	NO2C15H17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	216.126263
ΔH_f, kcal/mol:	-45.46
Dipole, Da:	5.55
IP(EA), eV:	-9.07(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)prop-2-enamide

Drug info:

PubChemData

Smile

C=CC(=O)N1CCCC2(C1)C3=CC=CC=C3CO2

DOS

IR

Vibrations