Geometry & MOs

Info

ID:

57151

PubChem CID:

22395400

Reduced:

KC3O5H6 (1)

Stoich.:

AB3C5D6 (1)

Weight, g/mol:

129.042593

ΔHf, kcal/mol:

-252.58

Dipole, Da:

5.25

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.753899

Charge, e:

 0

Chem-info

IUPAC name:

2,4-dioxopentanamide

Drug info:

PubChemData

Smile

[CH3-].C(=O)[O-].C(=O)(O)O.[K+]

DOS

IR

Vibrations