Geometry & MOs

Info

ID:	2738
PubChem CID:	8429
Reduced:	Cl3O3C13H15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	324.008677
ΔH_f, kcal/mol:	-139.1
Dipole, Da:	3.42
IP(EA), eV:	-9.22(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentyl 2-(2,4,5-trichlorophenoxy)acetate

Drug info:

PubChemData

Smile

CCCCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl

DOS

IR

Vibrations