Geometry & MOs

Info

ID:

222113

PubChem CID:

85294269

Reduced:

O7C16H19 (2)

Stoich.:

A7B16C19 (2)

Weight, g/mol:

654.288756

ΔHf, kcal/mol:

-608.24

Dipole, Da:

10.25

IP(EA), eV:

 -9.29(-1.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2,7,9,10,13-pentaacetyloxy-4,5-dihydroxy-8,12,15,15-tetramethyl-4-tricyclo[9.3.1.03,8]pentadec-11-enyl)methyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCC(COC(=O)C)C1=C(C2=C(C(=C1OC(=O)C)OC(=O)C)C3(CC(CC(C3=C(C2=O)OC(=O)C)(C)C)OC(=O)C)C)O

DOS

IR

Vibrations