Geometry & MOs

Info

ID:	375030
PubChem CID:	131465257
Reduced:	N4C11H16 (1)
Stoich.:	A4B11C16 (1)
Weight, g/mol:	211.084458
ΔH_f, kcal/mol:	37.9
Dipole, Da:	2.64
IP(EA), eV:	-8.88(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-ethoxy-2-oxoethyl)-1-methylpyrrole-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC2=C(C1)NC(=N2)C(CCN)C#N

DOS

IR

Vibrations