Geometry & MOs

Info

ID:	61877
PubChem CID:	26715354
Reduced:	ClSN2O5C17H19 (1)
Stoich.:	ABC2D5E17F19 (1)
Weight, g/mol:	424.085971
ΔH_f, kcal/mol:	-158.22
Dipole, Da:	9.98
IP(EA), eV:	-9.53(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-N-[4-(methylsulfamoyl)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC)OC

DOS

IR

Vibrations