Geometry & MOs

Info

ID:	242512
PubChem CID:	97301732
Reduced:	ClFO2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	273.022447
ΔH_f, kcal/mol:	-90.36
Dipole, Da:	0.74
IP(EA), eV:	-9.38(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-amino-4-(trifluoromethoxy)phenyl]-2,2,2-trifluoroethanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1OC2=C(C=CC(=C2)F)CO)Cl

DOS

IR

Vibrations