Geometry & MOs

Info

ID:	243408
PubChem CID:	99222762
Reduced:	ClN2O4C19H21 (1)
Stoich.:	AB2C4D19E21 (1)
Weight, g/mol:	356.173607
ΔH_f, kcal/mol:	-95.33
Dipole, Da:	2.61
IP(EA), eV:	-8.73(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-ethoxy-4-methoxyphenyl)-N-ethyl-N-(6-methoxypyridin-3-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CCN(C1=CN=C(C=C1)OC)C(=O)/C=C/C2=CC(=C(C(=C2)Cl)OC)OC

DOS

IR

Vibrations