Geometry & MOs

Info

ID:	260953
PubChem CID:	103210741
Reduced:	ClO2F4C12H13 (1)
Stoich.:	AB2C4D12E13 (1)
Weight, g/mol:	286.03837
ΔH_f, kcal/mol:	-287.95
Dipole, Da:	5.99
IP(EA), eV:	-9.29(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-chloro-2-(2,2,2-trifluoroethoxy)ethyl]-2-fluoro-4-methoxybenzene

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(CCOCC(F)(F)F)Cl)F

DOS

IR

Vibrations