Geometry & MOs

Info

ID:	124751
PubChem CID:	50894932
Reduced:	NSO6C18H21 (1)
Stoich.:	ABC6D18E21 (1)
Weight, g/mol:	368.084221
ΔH_f, kcal/mol:	-199.74
Dipole, Da:	4.94
IP(EA), eV:	-8.38(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-(4-fluorophenyl)sulfonyl-2,5-dimethoxyanilino)acetamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)N(CCCC(=O)O)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations