Geometry & MOs

Info

ID:	204366
PubChem CID:	79954750
Reduced:	OF3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	299.05917
ΔH_f, kcal/mol:	-238.74
Dipole, Da:	3.68
IP(EA), eV:	-10.39(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5,5-trifluoro-1-(4-phenyl-1,3-thiazol-2-yl)pentan-2-one

Drug info:

PubChemData

Smile

CCCCCC(=O)CCC(F)(F)F

DOS

IR

Vibrations