Geometry & MOs

Info

ID:

6778

PubChem CID:

69986

Reduced:

NO3H5C6 (1)

Stoich.:

AB3C5D6 (1)

Weight, g/mol:

139.026943

ΔHf, kcal/mol:

-60.55

Dipole, Da:

6.74

IP(EA), eV:

-10.21(-1.64)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-oxidopyridin-1-ium-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=[N+](C(=C1)C(=O)O)[O-]

DOS

IR

Vibrations