Geometry & MOs

Info

ID:	405270
PubChem CID:	135073319
Reduced:	OH16C17 (1)
Stoich.:	AB16C17 (1)
Weight, g/mol:	240.095043
ΔH_f, kcal/mol:	9.59
Dipole, Da:	3.13
IP(EA), eV:	-9.48(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-(4-fluorophenyl)-3-phenylbut-2-en-1-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)/C=C(\C)/C2=CC=CC=C2

DOS

IR

Vibrations