Geometry & MOs

Info

ID:	261011
PubChem CID:	103214099
Reduced:	ClIOSH10C13 (1)
Stoich.:	ABCDE10F13 (1)
Weight, g/mol:	254.03662
ΔH_f, kcal/mol:	23.44
Dipole, Da:	3.03
IP(EA), eV:	-9.15(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-difluorophenyl)-2-(2,2,2-trifluoroethoxy)ethanone

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)CCC2=CSC=C2)Cl)I

DOS

IR

Vibrations