Geometry & MOs

Info

ID:	11723
PubChem CID:	119843
Reduced:	Cl3O4C16H21 (1)
Stoich.:	A3B4C16D21 (1)
Weight, g/mol:	382.050542
ΔH_f, kcal/mol:	-191.95
Dipole, Da:	3.5
IP(EA), eV:	-9.17(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butoxypropyl 2-(2,4,5-trichlorophenoxy)propanoate

Drug info:

PubChemData

Smile

CCCCOC(C)COC(=O)C(C)OC1=CC(=C(C=C1Cl)Cl)Cl

DOS

IR

Vibrations