Geometry & MOs

Info

ID:	4705
PubChem CID:	11893
Reduced:	NO3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	197.105193
ΔH_f, kcal/mol:	-147.92
Dipole, Da:	1.94
IP(EA), eV:	-10.03(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetyl-2-butan-2-yl-5-hydroxy-1,2-dihydropyrrol-3-one

Drug info:

PubChemData

Smile

CCC(C)C1C(=O)C(=C(N1)O)C(=O)C

DOS

IR

Vibrations