Geometry & MOs

Info

ID:	375128
PubChem CID:	131472576
Reduced:	BrION2F3H5C7 (1)
Stoich.:	ABCD2E3F5G7 (1)
Weight, g/mol:	222.062698
ΔH_f, kcal/mol:	-153.91
Dipole, Da:	4.59
IP(EA), eV:	-9.42(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-fluoro-3-methylphenyl)methyl]-1,2-thiazol-3-amine

Drug info:

PubChemData

Smile

C1=C(C(=C(N=C1N)CBr)OC(F)(F)F)I

DOS

IR

Vibrations