Geometry & MOs

Info

ID:	271784
PubChem CID:	103691525
Reduced:	ClSC8H15 (1)
Stoich.:	ABC8D15 (1)
Weight, g/mol:	160.109944
ΔH_f, kcal/mol:	-31.61
Dipole, Da:	1.39
IP(EA), eV:	-8.7(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-pentan-2-yloxypropanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)SCC(=C)CCl

DOS

IR

Vibrations