Geometry & MOs

Info

ID:	16677
PubChem CID:	474647
Reduced:	SN2F5H9C16 (1)
Stoich.:	AB2C5D9E16 (1)
Weight, g/mol:	356.04066
ΔH_f, kcal/mol:	-175.85
Dipole, Da:	6.54
IP(EA), eV:	-9.53(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C2=NC3=C(N2C(S1)C4=C(C=CC=C4F)F)C=CC(=C3)C(F)(F)F

DOS

IR

Vibrations