Geometry & MOs

Info

ID:	143913
PubChem CID:	53282216
Reduced:	SN2O4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	358.119858
ΔH_f, kcal/mol:	-126.87
Dipole, Da:	6.5
IP(EA), eV:	-9.0(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(2-methoxyethyl)butanamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)CC

DOS

IR

Vibrations