Geometry & MOs

Info

ID:	63753
PubChem CID:	26759123
Reduced:	ClNS2O5H16C17 (1)
Stoich.:	ABC2D5E16F17 (1)
Weight, g/mol:	472.166808
ΔH_f, kcal/mol:	-165.47
Dipole, Da:	7.06
IP(EA), eV:	-8.96(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CSC1=CC(=C(C=C1)Cl)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

DOS

IR

Vibrations