Geometry & MOs

Info

ID:	203541
PubChem CID:	79842832
Reduced:	ClS2N3O4C11H20 (1)
Stoich.:	AB2C3D4E11F20 (1)
Weight, g/mol:	274.078742
ΔH_f, kcal/mol:	-169.35
Dipole, Da:	1.92
IP(EA), eV:	-9.59(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-fluoro-N-methyl-N-(2-methylsulfonylethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CCCl)C)S(=O)(=O)N(C)CCS(=O)(=O)C

DOS

IR

Vibrations