Geometry & MOs

Info

ID:	403794
PubChem CID:	135061922
Reduced:	N2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	342.157957
ΔH_f, kcal/mol:	-104.18
Dipole, Da:	6.02
IP(EA), eV:	-8.6(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[[(E)-3-ethoxy-3-oxo-1-phenylprop-1-enyl]amino]-1-methylpyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(N1C)C(=O)C=C(N2)C

DOS

IR

Vibrations