Geometry & MOs

Info

ID:	18892
PubChem CID:	550596
Reduced:	H2O2F3C5 (2)
Stoich.:	A2B2C3D5 (2)
Weight, g/mol:	302.001378
ΔH_f, kcal/mol:	-426.81
Dipole, Da:	0.52
IP(EA), eV:	-10.06(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2,2,2-trifluoroacetyl)oxyphenyl] 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1OC(=O)C(F)(F)F)OC(=O)C(F)(F)F

DOS

IR

Vibrations