Geometry & MOs

Info

ID:

411157

PubChem CID:

135083967

Reduced:

PO2C14H20 (1)

Stoich.:

AB2C14D20 (1)

Weight, g/mol:

275.098963

ΔHf, kcal/mol:

-71.28

Dipole, Da:

0.38

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.877786

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C@H]1C2C([C@@H](P1[C]3[CH][CH][CH][CH]3)C)OC(O2)(C)C

DOS

IR

Vibrations