Geometry & MOs

Info

ID:	79410
PubChem CID:	49748500
Reduced:	FN2S3O6H19C21 (1)
Stoich.:	AB2C3D6E19F21 (1)
Weight, g/mol:	510.04862
ΔH_f, kcal/mol:	-208.19
Dipole, Da:	7.57
IP(EA), eV:	-8.73(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-4-methoxybenzenesulfonamide

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC3=C(CCCN3S(=O)(=O)C4=CC=C(C=C4)F)C=C2

DOS

IR

Vibrations