Geometry & MOs

Info

ID:

20289

PubChem CID:

582957

Reduced:

O5C8H14 (1)

Stoich.:

A5B8C14 (1)

Weight, g/mol:

190.084124

ΔHf, kcal/mol:

-232.13

Dipole, Da:

1.74

IP(EA), eV:

-10.76(0.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

dimethyl 3-hydroxy-2,2-dimethylbutanedioate

Drug info:

PubChemData

Smile

CC(C)(C(C(=O)OC)O)C(=O)OC

DOS

IR

Vibrations