Geometry & MOs

Info

ID:

84562

PubChem CID:

49867913

Reduced:

ZnO3H9 (1)

Stoich.:

AB3C9 (1)

Weight, g/mol:

174.052823

ΔHf, kcal/mol:

-3.66

Dipole, Da:

1.66

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.751386

Charge, e:

0

Chem-info

IUPAC name:

(5R)-3,4,5-trihydroxycyclohexene-1-carboxylic acid

Drug info:

PubChemData

Smile

[OH3+].[OH3+].[OH3+].[Zn+2]

DOS

IR

Vibrations