Geometry & MOs

Info

ID:	83769
PubChem CID:	49861193
Reduced:	OCl2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	261.051634
ΔH_f, kcal/mol:	-36.74
Dipole, Da:	5.83
IP(EA), eV:	-8.89(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[amino-(hydroxyamino)methylidene]amino]phenoxy]acetic acid;hydrochloride

Drug info:

PubChemData

Smile

CN1C2=CC=CC(=C2N=C1C3=CC=CC=C3)C(=O)NCCN(C)C.Cl.Cl

DOS

IR

Vibrations