Geometry & MOs

Info

ID:

16231

PubChem CID:

462364

Reduced:

ONa2S2N3C12H12 (1)

Stoich.:

AB2C2D3E12F12 (1)

Weight, g/mol:

324.021718

ΔHf, kcal/mol:

-77.13

Dipole, Da:

9.12

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.236724

Charge, e:

1

Chem-info

IUPAC name:

disodium;8-amino-10H-phenazin-2-one;sulfane;sulfanide

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1N)NC3=CC(=O)C=CC3=N2.[Na+].[Na+].S.[SH-]

DOS

IR

Vibrations