Geometry & MOs

Info

ID:

1579

PubChem CID:

4721

Reduced:

O2C21H29 (2)

Stoich.:

A2B21C29 (2)

Weight, g/mol:

626.43351

ΔHf, kcal/mol:

-120.57

Dipole, Da:

3.06

IP(EA), eV:

 -8.54(-0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[2-hydroxy-5-(3,7,11-trimethyldodeca-1,6,10-trien-3-yl)phenoxy]-5-(3,7,11-trimethyldodeca-1,6,10-trien-3-yl)benzene-1,2-diol

Drug info:

PubChemData

Smile

CC(=CCCC(=CCCC(C)(C=C)C1=CC(=C(C=C1)O)OC2=CC(=CC(=C2O)O)C(C)(CCC=C(C)CCC=C(C)C)C=C)C)C

DOS

IR

Vibrations