Geometry & MOs

Info

ID:	20036
PubChem CID:	577238
Reduced:	O2F5H9C15 (1)
Stoich.:	A2B5C9D15 (1)
Weight, g/mol:	316.05227
ΔH_f, kcal/mol:	-262.38
Dipole, Da:	2.91
IP(EA), eV:	-9.79(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3,4,5,6-pentafluorophenyl)methyl 3-methylbenzoate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)OCC2=C(C(=C(C(=C2F)F)F)F)F

DOS

IR

Vibrations