Geometry & MOs

Info

ID:	430646
PubChem CID:	135170712
Reduced:	NO4C12H19 (1)
Stoich.:	AB4C12D19 (1)
Weight, g/mol:	211.120843
ΔH_f, kcal/mol:	-175.99
Dipole, Da:	2.92
IP(EA), eV:	-9.92(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethyl-1-methyl-5-oxo-2H-pyrrol-2-yl) 2-methylpropanoate

Drug info:

PubChemData

Smile

CCOC(=O)OC1C=C(C(=O)N1C)C(C)(C)C

DOS

IR

Vibrations