Geometry & MOs

Info

ID:	160416
PubChem CID:	57309764
Reduced:	N4C7H12 (1)
Stoich.:	A4B7C12 (1)
Weight, g/mol:	613.984809
ΔH_f, kcal/mol:	71.17
Dipole, Da:	6.8
IP(EA), eV:	-11.22(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4,6-dichloro-1,3,5-triazin-2-yl)methylamino]-3-[(4-methoxy-2-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid

Drug info:

PubChemData

Smile

C1CC(C1)CCN2C=NN=N2

DOS

IR

Vibrations