Geometry & MOs

Info

ID:	230910
PubChem CID:	87572235
Reduced:	Cl2O5C10H14 (1)
Stoich.:	A2B5C10D14 (1)
Weight, g/mol:	284.066281
ΔH_f, kcal/mol:	-242.04
Dipole, Da:	1.88
IP(EA), eV:	-10.41(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-2-ethyl-3-(2-methoxyacetyl)oxypentanedioic acid;hydrochloride

Drug info:

PubChemData

Smile

CCC(C(CC(=O)Cl)OC(=O)COC)C(=O)Cl

DOS

IR

Vibrations