Geometry & MOs

Info

ID:	196065
PubChem CID:	78775718
Reduced:	ClN2O3C21H25 (1)
Stoich.:	AB2C3D21E25 (1)
Weight, g/mol:	326.163043
ΔH_f, kcal/mol:	-83.03
Dipole, Da:	2.7
IP(EA), eV:	-8.61(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxy-4-prop-2-enylphenoxy)-N-(1-pyridin-4-ylethyl)acetamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1Cl)/C=C/C(=O)NC(C)C2=CC=NC=C2)OCC

DOS

IR

Vibrations