Geometry & MOs

Info

ID:

833

PubChem CID:

3414

Reduced:

CPO5 (1)

Stoich.:

ABC5 (1)

Weight, g/mol:

122.948335

ΔHf, kcal/mol:

-95.37

Dipole, Da:

0.99

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.787139

Charge, e:

 -3

Chem-info

IUPAC name:

phosphonatoformate

Drug info:

PubChemData

Smile

C(=O)([O-])P(=O)([O-])[O-]

DOS

IR

Vibrations