Geometry & MOs

Info

ID:

221803

PubChem CID:

85286159

Reduced:

SSiO7C34H44 (1)

Stoich.:

ABC7D34E44 (1)

Weight, g/mol:

624.36936

ΔHf, kcal/mol:

-304.85

Dipole, Da:

5.74

IP(EA), eV:

 -8.91(-0.95)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-hydroxy-6-(2-methoxyethoxymethoxy)-7-[(4-methoxyphenyl)methoxy]-5,5,11,11-tetramethyl-1-(2-trimethylsilylethoxymethoxy)bicyclo[6.2.1]undecan-2-one

Drug info:

PubChemData

Smile

CC(=CCO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)CCC(C(C)(COS(=O)(=O)C)O)OC(=O)C3=CC=CC=C3

DOS

IR

Vibrations