Geometry & MOs

Info

ID:

409338

PubChem CID:

135082118

Reduced:

O2C10H11 (1)

Stoich.:

A2B10C11 (1)

Weight, g/mol:

232.050176

ΔHf, kcal/mol:

-34.04

Dipole, Da:

2.86

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.327653

Charge, e:

 1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations