Geometry & MOs

Info

ID:	257521
PubChem CID:	103146788
Reduced:	N2F3O4C11H13 (1)
Stoich.:	A2B3C4D11E13 (1)
Weight, g/mol:	288.097329
ΔH_f, kcal/mol:	-278.07
Dipole, Da:	5.57
IP(EA), eV:	-9.55(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-cyclopropyloxyphenyl)-3-(2,2,2-trifluoroethoxy)propan-1-one

Drug info:

PubChemData

Smile

COC1=CN=C(C(=N1)OC)C(=O)CCOCC(F)(F)F

DOS

IR

Vibrations