Geometry & MOs

Info

ID:

426029

PubChem CID:

135135025

Reduced:

N3O6C14H14 (1)

Stoich.:

A3B6C14D14 (1)

Weight, g/mol:

286.131742

ΔHf, kcal/mol:

-82.23

Dipole, Da:

5.93

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.430473

Charge, e:

2

Chem-info

IUPAC name:

10-hydroxy-1,5-dimethoxy-7,8-dimethylphenazine-5,10-diium

Drug info:

PubChemData

Smile

C1C(=NO)C=CC=C1[N+](=O)C2=C(C=CC=C2OCC(=O)O)NO

DOS

IR

Vibrations