Geometry & MOs

Info

ID:

224512

PubChem CID:

85344206

Reduced:

I2Si2O7C38H64 (1)

Stoich.:

A2B2C7D38E64 (1)

Weight, g/mol:

948.720691

ΔHf, kcal/mol:

-366.16

Dipole, Da:

10.93

IP(EA), eV:

 -8.88(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-acetyloxy-5-(3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-2,3-dimethoxy-6-methylphenyl] acetate

Drug info:

PubChemData

Smile

CC(CC(=CI)C)C(C(C)C=C(C)C=C(C(=O)OC(=O)C(=CC(=CC(C)C(C(C)CC(=CI)C)O[Si](C)(C)C)C)OC)OC)O[Si](C)(C)C

DOS

IR

Vibrations