Geometry & MOs

Info

ID:	172772
PubChem CID:	75549874
Reduced:	ClN4O4C23H25 (1)
Stoich.:	AB4C4D23E25 (1)
Weight, g/mol:	479.151492
ΔH_f, kcal/mol:	-121.83
Dipole, Da:	11.18
IP(EA), eV:	-8.21(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

N-(1,4-dimethyl-2,3-dioxo-7-phenoxyquinoxaline-1,4-diium-6-yl)-2,3,5-trimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

C[N+]1=C2C=C(C(=CC2=[N+](C(=O)C1=O)C)N3CCCCC3)NC(=O)C4=C(C=C(C=C4)Cl)OC

DOS

IR

Vibrations