Geometry & MOs

Info

ID:	63966
PubChem CID:	26759579
Reduced:	FNO4C18H18 (1)
Stoich.:	ABC4D18E18 (1)
Weight, g/mol:	397.146013
ΔH_f, kcal/mol:	-179.65
Dipole, Da:	5.97
IP(EA), eV:	-9.1(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(diethylsulfamoyl)-4-methylphenyl]quinoline-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC(=CC=C1)F)OC(=O)CC2=CC=C(C=C2)OC

DOS

IR

Vibrations