Geometry & MOs

Info

ID:

230154

PubChem CID:

87570311

Reduced:

NNaOC14H29 (1)

Stoich.:

ABCD14E29 (1)

Weight, g/mol:

773.75215

ΔHf, kcal/mol:

-81.92

Dipole, Da:

3.71

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.750003

Charge, e:

0

Chem-info

IUPAC name:

biphenylen-1-yl [hydroxy-[hydroxy-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl] iodo phosphate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(=O)N.[Na]

DOS

IR

Vibrations