Geometry & MOs

Info

ID:	173276
PubChem CID:	75616802
Reduced:	NO4C16H19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	339.123736
ΔH_f, kcal/mol:	-131.41
Dipole, Da:	3.45
IP(EA), eV:	-8.71(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-5-ethoxy-4-methoxyphenyl)-N-(oxolan-2-ylmethyl)prop-2-enamide

Drug info:

PubChemData

Smile

C1CC(OC1)CNC(=O)C=CC2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations