Geometry & MOs

Info

ID:	264242
PubChem CID:	103445424
Reduced:	ClO2F3N3H7C11 (1)
Stoich.:	AB2C3D3E7F11 (1)
Weight, g/mol:	283.018225
ΔH_f, kcal/mol:	-130.79
Dipole, Da:	1.67
IP(EA), eV:	-10.12(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(3-chloropyridin-2-yl)-1,2,4-oxadiazol-5-yl]thiolan-3-ol

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C2=C(C=CC=N2)Cl)C(=O)C(F)(F)F

DOS

IR

Vibrations