Geometry & MOs

Info

ID:	130270
PubChem CID:	51075452
Reduced:	O2N3H15C16 (1)
Stoich.:	A2B3C15D16 (1)
Weight, g/mol:	348.097763
ΔH_f, kcal/mol:	0.19
Dipole, Da:	4.91
IP(EA), eV:	-9.26(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethylsulfonylamino)-N-(5-fluoro-2-methylphenyl)-4-methylsulfanylbutanamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC=CC=C1OCC2=CN3C=CC=CC3=N2

DOS

IR

Vibrations