Geometry & MOs

Info

ID:	8650
PubChem CID:	79871
Reduced:	AsO3N6C9H11 (1)
Stoich.:	AB3C6D9E11 (1)
Weight, g/mol:	326.010858
ΔH_f, kcal/mol:	-30.08
Dipole, Da:	3.24
IP(EA), eV:	-8.96(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl]arsonic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NC2=NC(=NC(=N2)N)N)[As](=O)(O)O

DOS

IR

Vibrations