Geometry & MOs

Info

ID:	424731
PubChem CID:	135123725
Reduced:	N4O5C37H38 (1)
Stoich.:	A4B5C37D38 (1)
Weight, g/mol:	429.89868
ΔH_f, kcal/mol:	-86.56
Dipole, Da:	5.38
IP(EA), eV:	-8.65(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(bromomethoxy)-10-oxidophenazin-5-ium 5-oxide

Drug info:

PubChemData

Smile

CCN1C2=C(C(=C(C=C2)C(CC(=O)N3C(COC3=O)C4=CC=CC=C4)C5=CC(=C(C=C5)C)COCC6=CC=C(C=C6)OC)C)N=N1

DOS

IR

Vibrations