Geometry & MOs

Info

ID:	254485
PubChem CID:	103125616
Reduced:	OF3N3H8C14 (1)
Stoich.:	AB3C3D8E14 (1)
Weight, g/mol:	180.051047
ΔH_f, kcal/mol:	-90.9
Dipole, Da:	3.27
IP(EA), eV:	-9.52(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,3,3-trifluoropropyl)-1H-imidazol-2-one

Drug info:

PubChemData

Smile

C1=CC2=C(C=NN2C=C1)C(=O)C3=C(C=CN=C3)C(F)(F)F

DOS

IR

Vibrations