Geometry & MOs

Info

ID:

191650

PubChem CID:

78172851

Reduced:

O5C23H30 (1)

Stoich.:

A5B23C30 (1)

Weight, g/mol:

606.319268

ΔHf, kcal/mol:

-219.94

Dipole, Da:

6.58

IP(EA), eV:

 -8.63(0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

19-(furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione;1-methyl-4-prop-1-en-2-ylcyclohexene

Drug info:

PubChemData

Smile

CC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4OC)OC(=O)C)C

DOS

IR

Vibrations