Geometry & MOs

Info

ID:	128993
PubChem CID:	51065670
Reduced:	ClN2O2H17C19 (1)
Stoich.:	AB2C2D17E19 (1)
Weight, g/mol:	324.127406
ΔH_f, kcal/mol:	-26.47
Dipole, Da:	2.68
IP(EA), eV:	-8.6(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenoxy)-N-(8-methylquinolin-5-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(C=C1)NC(=O)C(C)OC3=CC=CC=C3Cl)C=CC=N2

DOS

IR

Vibrations