Geometry & MOs

Info

ID:

386853

PubChem CID:

134983151

Reduced:

O2H11C12 (2)

Stoich.:

A2B11C12 (2)

Weight, g/mol:

490.19328

ΔHf, kcal/mol:

-49.61

Dipole, Da:

2.41

IP(EA), eV:

 -8.44(-0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(20Z)-12,29-dioxaheptacyclo[28.8.0.02,11.03,8.014,19.022,27.033,38]octatriaconta-1(30),2(11),3,5,7,9,14,16,18,20,22,24,26,31,33,35,37-heptadecaene

Drug info:

PubChemData

Smile

COC1=C2C=C(/C=C\C3=CC(=CC(=C3)OC)OCC4=CC=CC=C4CO2)C=C1

DOS

IR

Vibrations