Geometry & MOs

Info

ID:	124625
PubChem CID:	50889977
Reduced:	SN2O6C17H18 (1)
Stoich.:	AB2C6D17E18 (1)
Weight, g/mol:	322.078742
ΔH_f, kcal/mol:	-129.46
Dipole, Da:	4.84
IP(EA), eV:	-9.49(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-(4-fluorophenyl)sulfonyl-3-methylanilino)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)CN(C1=CC=CC(=C1)C)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

DOS

IR

Vibrations