Geometry & MOs

Info

ID:	242513
PubChem CID:	97301759
Reduced:	NO2H5F6C9 (1)
Stoich.:	AB2C5D6E9 (1)
Weight, g/mol:	273.022447
ΔH_f, kcal/mol:	-375.57
Dipole, Da:	3.13
IP(EA), eV:	-9.65(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-amino-6-(trifluoromethoxy)phenyl]-2,2,2-trifluoroethanone

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1OC(F)(F)F)N)C(=O)C(F)(F)F

DOS

IR

Vibrations