Geometry & MOs

Info

ID:	128992
PubChem CID:	51065620
Reduced:	ClSO2N4C24H25 (1)
Stoich.:	ABC2D4E24F25 (1)
Weight, g/mol:	340.097855
ΔH_f, kcal/mol:	-28.12
Dipole, Da:	3.26
IP(EA), eV:	-8.74(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenoxy)-N-(8-methylquinolin-5-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NCCC(=O)NC3=CC=CC(=C3C)C)Cl

DOS

IR

Vibrations