Geometry & MOs

Info

ID:	443018
PubChem CID:	135257419
Reduced:	OC3N4H7 (2)
Stoich.:	AB3C4D7 (2)
Weight, g/mol:	256.008868
ΔH_f, kcal/mol:	31.95
Dipole, Da:	3.54
IP(EA), eV:	-8.19(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-diamino-5,6-dihydro-[1,3]thiazolo[4,5-f][1,3]benzothiazole-4,8-diol

Drug info:

PubChemData

Smile

C12C(NC3=C(N1)NC(N3O)N)N(C(N2)N)O

DOS

IR

Vibrations