Geometry & MOs

Info

ID:	224922
PubChem CID:	85719204
Reduced:	FSN2O3H19C20 (1)
Stoich.:	ABC2D3E19F20 (1)
Weight, g/mol:	293.065654
ΔH_f, kcal/mol:	-83.72
Dipole, Da:	3.28
IP(EA), eV:	-8.96(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-(1,3-benzothiazol-2-yl)morpholine-4-carboximidothioate

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)CC2=CC=C(C=C2)OCCNS(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations