Geometry & MOs

Info

ID:	70220
PubChem CID:	47211745
Reduced:	SO3N4C12H14 (1)
Stoich.:	AB3C4D12E14 (1)
Weight, g/mol:	302.110042
ΔH_f, kcal/mol:	9.83
Dipole, Da:	7.72
IP(EA), eV:	-9.44(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3-fluoro-4-methylphenyl)sulfamoyl]ethyl]butanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC(=O)CN2C=C(C=N2)[N+](=O)[O-]

DOS

IR

Vibrations