Geometry & MOs

Info

ID:

391227

PubChem CID:

135003662

Reduced:

O2H17C24 (1)

Stoich.:

A2B17C24 (1)

Weight, g/mol:

618.25588

ΔHf, kcal/mol:

69.94

Dipole, Da:

2.75

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.591869

Charge, e:

 2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=C(C=O)C3=C[CH]C=C3)C=C(O2)C4=CC=CC=C4

DOS

IR

Vibrations