Geometry & MOs

Info

ID:	394457
PubChem CID:	135023021
Reduced:	ClOC9H9 (2)
Stoich.:	ABC9D9 (2)
Weight, g/mol:	268.084792
ΔH_f, kcal/mol:	-60.52
Dipole, Da:	5.23
IP(EA), eV:	-9.26(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8,9-dimethyl-7-oxo-5H-phenazine-2-carboxylic acid

Drug info:

PubChemData

Smile

COC([C@H]1C[C@@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl)OC

DOS

IR

Vibrations