Geometry & MOs

Info

ID:	254236
PubChem CID:	103123623
Reduced:	O2N7C12H13 (1)
Stoich.:	A2B7C12D13 (1)
Weight, g/mol:	280.078268
ΔH_f, kcal/mol:	56.58
Dipole, Da:	7.31
IP(EA), eV:	-9.82(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylindazol-3-yl)-1,3-benzothiazol-6-amine

Drug info:

PubChemData

Smile

CC(C(C)N1C(=NN=N1)C2=C3C=NC=CN3N=C2)C(=O)O

DOS

IR

Vibrations