Geometry & MOs

Info

ID:	227466
PubChem CID:	87561807
Reduced:	OSN2C8H9 (2)
Stoich.:	ABC2D8E9 (2)
Weight, g/mol:	360.071468
ΔH_f, kcal/mol:	-1.56
Dipole, Da:	4.17
IP(EA), eV:	-8.8(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[5-(1,1-dioxo-1,4-thiazinan-4-yl)pyridin-3-yl]-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

C1CS(CCN1C2=CN=CC(=C2)C3=CC4=C(C=C3)N=C(S4)N)(O)O

DOS

IR

Vibrations