Geometry & MOs

Info

ID:

23609

PubChem CID:

605101

Reduced:

O5C33H50 (1)

Stoich.:

A5B33C50 (1)

Weight, g/mol:

526.365825

ΔHf, kcal/mol:

-259.81

Dipole, Da:

3.0

IP(EA), eV:

 -9.67(0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 16-acetyloxy-15-formyl-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5-carboxylate

Drug info:

PubChemData

Smile

CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)OC(=O)C)C=O)C)C)C(=O)OC

DOS

IR

Vibrations