Geometry & MOs

Info

ID:	435709
PubChem CID:	135192217
Reduced:	ClN2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	390.141342
ΔH_f, kcal/mol:	-63.55
Dipole, Da:	7.61
IP(EA), eV:	-9.02(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluoro-4-methylphenyl)-N-(2-hydroxy-1-propyl-2H-quinolin-6-yl)methanesulfonamide

Drug info:

PubChemData

Smile

C1CC=CC(C1)CC23C(C(C(=O)N2)NCCl)OC3=O

DOS

IR

Vibrations