Geometry & MOs

Info

ID:	337858
PubChem CID:	127258481
Reduced:	Cl2O5C16H18 (1)
Stoich.:	A2B5C16D18 (1)
Weight, g/mol:	277.027249
ΔH_f, kcal/mol:	-232.57
Dipole, Da:	4.72
IP(EA), eV:	-9.78(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dichloropyridin-3-yl)oxyethyl butanoate

Drug info:

PubChemData

Smile

CCC(C(=O)C(C1=C(C=C(C=C1)Cl)Cl)C(C)CC(=O)O)C(=O)O

DOS

IR

Vibrations