Geometry & MOs

Info

ID:	217701
PubChem CID:	85088240
Reduced:	HgO5C8H15 (1)
Stoich.:	AB5C8D15 (1)
Weight, g/mol:	333.041463
ΔH_f, kcal/mol:	-144.68
Dipole, Da:	6.08
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.762645
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethyl-1,2,4-trioxan-5-yl)methylmercury

Drug info:

PubChemData

Smile

CC1OC(COO1)(C)C[Hg].CC(=O)O

DOS

IR

Vibrations