Geometry & MOs

Info

ID:

327070

PubChem CID:

126688957

Reduced:

O2C4H5 (6)

Stoich.:

A2B4C5 (6)

Weight, g/mol:

510.173726

ΔHf, kcal/mol:

-507.41

Dipole, Da:

2.51

IP(EA), eV:

 -9.49(-0.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O[C@@H](C)C(=O)O[C@@H](C)C(=O)O[C@@H](C)C(=O)O[C@@H](C)C(=O)OCC1=CC=CC=C1)OC(=O)C

DOS

IR

Vibrations