Geometry & MOs

Info

ID:	28489
PubChem CID:	827952
Reduced:	ClSO2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	322.131742
ΔH_f, kcal/mol:	-67.55
Dipole, Da:	5.41
IP(EA), eV:	-9.62(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-hydroxy-N-(4-methylphenyl)-4-oxoquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)S(=O)(=O)C2=CC(=CC=C2)Cl)C

DOS

IR

Vibrations