Geometry & MOs

Info

ID:	67860
PubChem CID:	46507313
Reduced:	ClNSF2O3H8C15 (1)
Stoich.:	ABCD2E3F8G15 (1)
Weight, g/mol:	372.978726
ΔH_f, kcal/mol:	-157.96
Dipole, Da:	7.06
IP(EA), eV:	-9.87(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-3-(3,4-difluorophenyl)sulfonyl-8-fluoro-1H-quinolin-4-one

Drug info:

PubChemData

Smile

C1=CC(=CC=C1F)S(=O)(=O)C2=CNC3=CC(=C(C=C3C2=O)F)Cl

DOS

IR

Vibrations