Geometry & MOs

Info

ID:	16678
PubChem CID:	474650
Reduced:	ClSN2F4H9C16 (1)
Stoich.:	ABC2D4E9F16 (1)
Weight, g/mol:	372.01111
ΔH_f, kcal/mol:	-137.81
Dipole, Da:	4.47
IP(EA), eV:	-9.46(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-6-fluorophenyl)-7-(trifluoromethyl)-1,3-dihydro-[1,3]thiazolo[3,4-a]benzimidazole

Drug info:

PubChemData

Smile

C1C2=NC3=C(N2C(S1)C4=C(C=CC=C4Cl)F)C=C(C=C3)C(F)(F)F

DOS

IR

Vibrations