Geometry & MOs

Info

ID:	154141
PubChem CID:	56313540
Reduced:	SF2N2O4C21H24 (1)
Stoich.:	AB2C2D4E21F24 (1)
Weight, g/mol:	412.10237
ΔH_f, kcal/mol:	-218.13
Dipole, Da:	5.12
IP(EA), eV:	-9.6(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chlorophenyl)sulfonyl-methylamino]-N-[2-(2-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=C(C=C1)F)S(=O)(=O)N2CCOCC2)C3=CC=CC=C3F

DOS

IR

Vibrations