Geometry & MOs

Info

ID:	337364
PubChem CID:	127257049
Reduced:	Cl2N2O2F3C13H15 (1)
Stoich.:	A2B2C2D3E13F15 (1)
Weight, g/mol:	271.961869
ΔH_f, kcal/mol:	-231.25
Dipole, Da:	1.92
IP(EA), eV:	-9.42(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4-dichlorophenyl)methyl 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

C1CNCC1N.C1=CC(=C(C=C1COC(=O)C(F)(F)F)Cl)Cl

DOS

IR

Vibrations