Geometry & MOs

Info

ID:

385339

PubChem CID:

134978808

Reduced:

AlO2C10H22 (1)

Stoich.:

AB2C10D22 (1)

Weight, g/mol:

244.128342

ΔHf, kcal/mol:

-158.41

Dipole, Da:

3.3

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.758663

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(C)(C)O[Al-]OC(C)(C)CC

DOS

IR

Vibrations