Geometry & MOs

Info

ID:	177981
PubChem CID:	76259780
Reduced:	SN2O4C17H26 (1)
Stoich.:	AB2C4D17E26 (1)
Weight, g/mol:	352.145678
ΔH_f, kcal/mol:	-149.72
Dipole, Da:	8.4
IP(EA), eV:	-8.78(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1-benzofuran-5-yl)-N-[3-[ethylsulfonyl(methyl)amino]propyl]prop-2-enamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N(C)CCCNC(=O)C=CC1=C(C=CC(=C1)C)OC

DOS

IR

Vibrations