Geometry & MOs

Info

ID:	430429
PubChem CID:	135170493
Reduced:	NO3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	225.136493
ΔH_f, kcal/mol:	-113.0
Dipole, Da:	5.09
IP(EA), eV:	-9.67(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=O)N(C1OC(=O)C2CC2)C

DOS

IR

Vibrations