Geometry & MOs

Info

ID:	67852
PubChem CID:	46507301
Reduced:	O2N4H18C21 (1)
Stoich.:	A2B4C18D21 (1)
Weight, g/mol:	404.919626
ΔH_f, kcal/mol:	48.56
Dipole, Da:	2.75
IP(EA), eV:	-8.13(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-3-(3,5-dichlorophenyl)sulfonyl-6-fluoro-1H-quinolin-4-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN3C=CN=C(C3=C2C=O)NC4=CC=CC=C4OC

DOS

IR

Vibrations