Geometry & MOs

Info

ID:	207775
PubChem CID:	80447626
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	282.06792
ΔH_f, kcal/mol:	-115.6
Dipole, Da:	2.78
IP(EA), eV:	-8.25(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(2,3,4,5,6-pentafluorophenoxy)pentan-2-one

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)OCC(=O)C(C)CC

DOS

IR

Vibrations