Geometry & MOs

Info

ID:	37883
PubChem CID:	8025307
Reduced:	O2F3H11C17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	257.102749
ΔH_f, kcal/mol:	-170.53
Dipole, Da:	4.15
IP(EA), eV:	-9.29(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-4-[(4-methylphenyl)methylimino]pentan-2-one

Drug info:

PubChemData

Smile

C1/C(=C\C2=CC=CC=C2C(F)(F)F)/C(=O)C3=CC=CC=C3O1

DOS

IR

Vibrations