Geometry & MOs

Info

ID:	5929
PubChem CID:	14102
Reduced:	Cl2N2O2C7H8 (1)
Stoich.:	A2B2C2D7E8 (1)
Weight, g/mol:	221.996283
ΔH_f, kcal/mol:	-93.89
Dipole, Da:	3.34
IP(EA), eV:	-8.71(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

azanium;3-amino-2,5-dichlorobenzoate

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1C(=O)[O-])Cl)N)Cl.[NH4+]

DOS

IR

Vibrations