Geometry & MOs

Info

ID:	16072
PubChem CID:	459075
Reduced:	KNO3H4C6 (1)
Stoich.:	ABC3D4E6 (1)
Weight, g/mol:	176.982824
ΔH_f, kcal/mol:	-127.35
Dipole, Da:	7.5
IP(EA), eV:	-8.74(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;2-oxo-2-(1H-pyrrol-2-yl)acetate

Drug info:

PubChemData

Smile

C1=CNC(=C1)C(=O)C(=O)[O-].[K+]

DOS

IR

Vibrations