Geometry & MOs

Info

ID:	79407
PubChem CID:	49748488
Reduced:	N2S2F3O4H17C21 (1)
Stoich.:	A2B2C3D4E17F21 (1)
Weight, g/mol:	504.118892
ΔH_f, kcal/mol:	-226.75
Dipole, Da:	6.77
IP(EA), eV:	-8.78(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-5-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1CC2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=CC(=C3)F)F)N(C1)S(=O)(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations