Geometry & MOs

Info

ID:

218423

PubChem CID:

85089420

Reduced:

SiO5C26H44 (1)

Stoich.:

AB5C26D44 (1)

Weight, g/mol:

464.295801

ΔHf, kcal/mol:

-252.71

Dipole, Da:

3.7

IP(EA), eV:

 -8.72(-0.56)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[tert-butyl(dimethyl)silyl] 2-[3-acetyloxy-3a-methyl-6-(2-oxoethyl)-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-7-yl]acetate

Drug info:

PubChemData

Smile

CC1CC2C=CC(C(C2C(C1)O)C=CC(=O)CC(CC(=O)OC)O[Si](C)(C)C(C)(C)C)C

DOS

IR

Vibrations