Geometry & MOs

Info

ID:	388593
PubChem CID:	134989571
Reduced:	NCl2H9C14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	144.039573
ΔH_f, kcal/mol:	47.76
Dipole, Da:	2.64
IP(EA), eV:	-8.57(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydroxy-6-imino-5-oxido-1,2,4,5-tetrazin-5-ium-3-amine

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)Cl)NC3=C(C=C2)C=CC(=C3)Cl

DOS

IR

Vibrations