Geometry & MOs

Info

ID:	402301
PubChem CID:	135055378
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	228.095043
ΔH_f, kcal/mol:	-171.92
Dipole, Da:	5.81
IP(EA), eV:	-9.11(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(2-fluorophenyl)-2-phenylpropan-1-one

Drug info:

PubChemData

Smile

COC(=O)[C@@H]1[C@H](C2=C(C1=O)OCCC2)C3CCCCC3

DOS

IR

Vibrations