Geometry & MOs

Info

ID:

125671

PubChem CID:

50932931

Reduced:

IPbO2C13H20 (1)

Stoich.:

ABC2D13E20 (1)

Weight, g/mol:

495.04132

ΔHf, kcal/mol:

-20.59

Dipole, Da:

2.06

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.757870

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC[Pb](CC)CC.C1=CC=C(C(=C1)C(=O)O)I

DOS

IR

Vibrations