Geometry & MOs

Info

ID:	21773
PubChem CID:	589867
Reduced:	NOF3H8C10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	215.055798
ΔH_f, kcal/mol:	-158.83
Dipole, Da:	7.67
IP(EA), eV:	-9.71(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1,1,1-trifluoro-4-phenylbut-3-en-2-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations