Geometry & MOs

Info

ID:	405708
PubChem CID:	135075145
Reduced:	BClO2F3C15H17 (1)
Stoich.:	ABC2D3E15F17 (1)
Weight, g/mol:	264.018876
ΔH_f, kcal/mol:	-310.69
Dipole, Da:	3.93
IP(EA), eV:	-9.86(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;4-benzoylbenzoate

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)/C(=C\C2=CC=C(C=C2)C(F)(F)F)/Cl

DOS

IR

Vibrations