Geometry & MOs

Info

ID:

148549

PubChem CID:

53788215

Reduced:

SiC32H46 (1)

Stoich.:

AB32C46 (1)

Weight, g/mol:

752.325536

ΔHf, kcal/mol:

-38.29

Dipole, Da:

1.75

IP(EA), eV:

 -8.13(0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(20S)-4,22,23-triacetyloxy-5-[(1R)-1-acetyloxyethyl]-20-hydroperoxy-14,16-dihydroxy-1,8,10,20-tetramethyl-7,18-dioxaheptacyclo[11.10.0.02,10.05,9.014,21.017,19.019,21]tricosan-3-yl] acetate

Drug info:

PubChemData

Smile

CC1CC(C(C1)[Si](C2CCCC2)(C3CC(CC3C)C)C4C5=C(CC=CC5)C6=CC=CC=C46)C

DOS

IR

Vibrations