Geometry & MOs

Info

ID:	17423
PubChem CID:	497691
Reduced:	O2S3N5H7C11 (1)
Stoich.:	A2B3C5D7E11 (1)
Weight, g/mol:	336.976188
ΔH_f, kcal/mol:	62.3
Dipole, Da:	7.9
IP(EA), eV:	-8.99(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-thiazol-2-yl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole-1-sulfonamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N3C(=NN=C3S(=O)(=O)NC4=NC=CS4)S2

DOS

IR

Vibrations