Geometry & MOs

Info

ID:	198102
PubChem CID:	79047836
Reduced:	SO2N4C10H12 (1)
Stoich.:	AB2C4D10E12 (1)
Weight, g/mol:	256.023725
ΔH_f, kcal/mol:	-40.73
Dipole, Da:	2.95
IP(EA), eV:	-8.93(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-chloro-4-fluorophenyl)ethyl]-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CN1C=C(C(=O)N(C1=O)C)CNC2=NC=CS2

DOS

IR

Vibrations