Geometry & MOs

Info

ID:	424325
PubChem CID:	135122212
Reduced:	NH2F3O4C5 (1)
Stoich.:	AB2C3D4E5 (1)
Weight, g/mol:	406.114042
ΔH_f, kcal/mol:	-240.79
Dipole, Da:	3.05
IP(EA), eV:	-10.4(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-[3-[3-(trifluoromethoxy)phenyl]cyclopentyl]oxypyridin-3-yl]-1,2-oxazol-3-one

Drug info:

PubChemData

Smile

C1=C(ONC1=O)OC(=O)C(F)(F)F

DOS

IR

Vibrations