Geometry & MOs

Info

ID:

6026

PubChem CID:

14309

Reduced:

HgO3C7H7 (1)

Stoich.:

AB3C7D7 (1)

Weight, g/mol:

341.010163

ΔHf, kcal/mol:

-79.39

Dipole, Da:

3.82

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.838961

Charge, e:

 0

Chem-info

IUPAC name:

(4-carboxyphenyl)mercury;hydrate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)O)[Hg].O

DOS

IR

Vibrations