Geometry & MOs

Info

ID:

16139

PubChem CID:

460152

Reduced:

O3H15C16 (1)

Stoich.:

A3B15C16 (1)

Weight, g/mol:

255.102119

ΔHf, kcal/mol:

-14.96

Dipole, Da:

2.4

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.030445

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C=CC(=O)[C]2[CH][CH][CH][CH]2)OC

DOS

IR

Vibrations