Geometry & MOs

Info

ID:	198727
PubChem CID:	79141974
Reduced:	FSN3C15H18 (1)
Stoich.:	ABC3D15E18 (1)
Weight, g/mol:	335.97321
ΔH_f, kcal/mol:	4.61
Dipole, Da:	1.5
IP(EA), eV:	-8.25(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-fluorophenyl)-6-methyl-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

C1CCC(C1)N2C=CC(=N2)CSC3=CC(=C(C=C3)N)F

DOS

IR

Vibrations