Geometry & MOs

Info

ID:	22885
PubChem CID:	599438
Reduced:	O2F3H9C11 (1)
Stoich.:	A2B3C9D11 (1)
Weight, g/mol:	230.055464
ΔH_f, kcal/mol:	-202.46
Dipole, Da:	4.76
IP(EA), eV:	-10.59(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2-(trifluoromethyl)benzoate

Drug info:

PubChemData

Smile

C=CCOC(=O)C1=CC=CC=C1C(F)(F)F

DOS

IR

Vibrations