Geometry & MOs

Info

ID:

214993

PubChem CID:

85083968

Reduced:

O8C39H66 (1)

Stoich.:

A8B39C66 (1)

Weight, g/mol:

662.349034

ΔHf, kcal/mol:

-459.3

Dipole, Da:

4.93

IP(EA), eV:

 -9.72(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[3,4-bis(trimethylsilyloxy)-5-[[3-(3-trimethylsilyloxybutan-2-yl)oxiran-2-yl]methyl]oxan-2-yl]-1-hydroxy-5-methyl-1-phenylhexa-1,4-dien-3-one

Drug info:

PubChemData

Smile

CCCCCCCCCCC(C1CCC(O1)C2CCC(O2)C(CCCCCCCCCCC3=CC(OC3=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations