Geometry & MOs

Info

ID:

125672

PubChem CID:

50932932

Reduced:

BrPbO2C13H20 (1)

Stoich.:

ABC2D13E20 (1)

Weight, g/mol:

909.354117

ΔHf, kcal/mol:

23.23

Dipole, Da:

3.14

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.949333

Charge, e:

 6

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations