Geometry & MOs

Info

ID:	430687
PubChem CID:	135170753
Reduced:	NO3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	189.045964
ΔH_f, kcal/mol:	-139.03
Dipole, Da:	3.22
IP(EA), eV:	-9.74(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethylsulfanyl-1-hydroxy-2-methoxy-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

CC(C)C1=CC(N(C1=O)C)OC(=O)C(C)C

DOS

IR

Vibrations