Geometry & MOs

Info

ID:

327038

PubChem CID:

126688906

Reduced:

O8C11H16 (1)

Stoich.:

A8B11C16 (1)

Weight, g/mol:

294.110338

ΔHf, kcal/mol:

-361.78

Dipole, Da:

7.13

IP(EA), eV:

-10.7(-0.26)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[(2S)-1-oxo-1-phenylmethoxypropan-2-yl] (2S)-2-acetyloxypropanoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)OC(=O)[C@H](C)OC(=O)[C@H](C)OC(=O)C

DOS

IR

Vibrations