Geometry & MOs

Info

ID:	313797
PubChem CID:	126617807
Reduced:	SN3O3H9C11 (1)
Stoich.:	AB3C3D9E11 (1)
Weight, g/mol:	325.063346
ΔH_f, kcal/mol:	-31.65
Dipole, Da:	5.98
IP(EA), eV:	-8.99(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-6-oxopyridazin-3-yl)imidazo[2,1-b][1,3]benzothiazole-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC2=C(N=C1)SC3=NC(=CN23)C(=O)OC

DOS

IR

Vibrations