Geometry & MOs

Info

ID:	144935
PubChem CID:	53434353
Reduced:	ClFO2H14C15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	278.050986
ΔH_f, kcal/mol:	-97.69
Dipole, Da:	2.52
IP(EA), eV:	-9.13(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-chloro-3-fluorophenoxy)phenyl]propanal

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CCCO)OC2=CC(=C(C=C2)Cl)F

DOS

IR

Vibrations