Geometry & MOs

Info

ID:

214499

PubChem CID:

85083127

Reduced:

N2O2C16H19 (2)

Stoich.:

A2B2C16D19 (2)

Weight, g/mol:

542.360739

ΔHf, kcal/mol:

-134.8

Dipole, Da:

5.15

IP(EA), eV:

 -8.76(-0.47)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3,5-dihydroxy-6,10-dimethyl-2-methylidene-4-oxo-16-propan-2-yl-15-tetracyclo[9.7.0.03,7.013,17]octadeca-5,9-dienyl) 3-hydroxy-3,5-dimethylheptanoate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(C)C1=CC2=CC=CC=C2C=C1)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(C)C(=O)O

DOS

IR

Vibrations