Geometry & MOs

Info

ID:	430670
PubChem CID:	135170736
Reduced:	NO3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	197.105193
ΔH_f, kcal/mol:	-140.48
Dipole, Da:	3.44
IP(EA), eV:	-9.76(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,4-dimethyl-5-oxo-2H-pyrrol-2-yl) 2-methylpropanoate

Drug info:

PubChemData

Smile

CCC(=O)OC1C=C(C(=O)N1C)C(C)(C)C

DOS

IR

Vibrations