Geometry & MOs

Info

ID:

219816

PubChem CID:

85164926

Reduced:

SiN3O5C33H55 (1)

Stoich.:

AB3C5D33E55 (1)

Weight, g/mol:

602.272712

ΔHf, kcal/mol:

-232.83

Dipole, Da:

3.93

IP(EA), eV:

 -8.52(-0.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[9,23-dihydroxy-22-methoxy-1,5,20-trimethyl-6-(5-oxo-2H-furan-3-yl)-11,17,19,24-tetraoxaheptacyclo[12.12.0.02,10.05,9.010,12.016,25.018,23]hexacos-14-en-7-yl] acetate

Drug info:

PubChemData

Smile

CC12CCC3C(C1CCC2O[Si](C)(C)C(C)(C)C)C(CC4=C3C=CC(=C4)OCOCCOC)CCCOCCN=[N+]=[N-]

DOS

IR

Vibrations