Geometry & MOs

Info

ID:	246224
PubChem CID:	103050128
Reduced:	ClFON2H14C16 (1)
Stoich.:	ABCD2E14F16 (1)
Weight, g/mol:	285.017969
ΔH_f, kcal/mol:	-51.0
Dipole, Da:	3.22
IP(EA), eV:	-8.74(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-[(5-chloro-2-fluorophenyl)methyl]-3,3,3-trifluoropropanoic acid

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N(C1=O)CC3=C(C=CC(=C3)Cl)F

DOS

IR

Vibrations