Geometry & MOs

Info

ID:	430599
PubChem CID:	135170665
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	227.115758
ΔH_f, kcal/mol:	-168.81
Dipole, Da:	3.03
IP(EA), eV:	-9.95(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-tert-butyl-1-methyl-5-oxo-2H-pyrrol-2-yl) methyl carbonate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations