Geometry & MOs

Info

ID:	182252
PubChem CID:	76864869
Reduced:	NO3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	303.092915
ΔH_f, kcal/mol:	-119.83
Dipole, Da:	4.28
IP(EA), eV:	-9.77(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-ethoxy-3-(hydroxymethyl)phenyl]-3-thiophen-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

CCCN(CC(=O)O)C(=O)C=CC=CC

DOS

IR

Vibrations