Geometry & MOs

Info

ID:	260947
PubChem CID:	103210545
Reduced:	ClOF3C12H14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	280.084177
ΔH_f, kcal/mol:	-211.62
Dipole, Da:	1.43
IP(EA), eV:	-9.4(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-chloro-3-(2,2,2-trifluoroethoxy)propyl]-2,4-dimethylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CCOCC(F)(F)F)Cl

DOS

IR

Vibrations