Geometry & MOs

Info

ID:	12864
PubChem CID:	147179
Reduced:	FO2H11C15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	242.074308
ΔH_f, kcal/mol:	-38.02
Dipole, Da:	2.26
IP(EA), eV:	-9.83(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3R)-3-(4-fluorophenyl)oxiran-2-yl]-phenylmethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)[C@@H]2[C@H](O2)C3=CC=C(C=C3)F

DOS

IR

Vibrations