Geometry & MOs

Info

ID:	168
PubChem CID:	2224
Reduced:	OF3C21H31 (1)
Stoich.:	AB3C21D31 (1)
Weight, g/mol:	356.2327
ΔH_f, kcal/mol:	-191.45
Dipole, Da:	4.04
IP(EA), eV:	-9.57(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluorohenicosa-6,9,12,15-tetraen-2-one

Drug info:

PubChemData

Smile

CCCCCC=CCC=CCC=CCC=CCCCC(=O)C(F)(F)F

DOS

IR

Vibrations