Geometry & MOs

Info

ID:

3845

PubChem CID:

10294

Reduced:

HgNO5C13H16 (1)

Stoich.:

ABC5D13E16 (1)

Weight, g/mol:

468.073491

ΔHf, kcal/mol:

-120.42

Dipole, Da:

2.55

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.959703

Charge, e:

 0

Chem-info

IUPAC name:

[3-[[2-(carboxymethoxy)benzoyl]amino]-2-methoxypropyl]mercury

Drug info:

PubChemData

Smile

COC(CNC(=O)C1=CC=CC=C1OCC(=O)O)C[Hg]

DOS

IR

Vibrations