Geometry & MOs

Info

ID:	394792
PubChem CID:	135023823
Reduced:	FSN3H10C16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	311.028396
ΔH_f, kcal/mol:	85.16
Dipole, Da:	5.39
IP(EA), eV:	-9.22(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(SC3=NC=NN23)C4=CC=CC=C4F

DOS

IR

Vibrations