Geometry & MOs

Info

ID:

59373

PubChem CID:

24844229

Reduced:

NaN2O3H14C20 (1)

Stoich.:

AB2C3D14E20 (1)

Weight, g/mol:

345.157897

ΔHf, kcal/mol:

-0.94

Dipole, Da:

9.54

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.793503

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CO3)C(=O)N2C4=CC=CC=C4.[Na]

DOS

IR

Vibrations