Geometry & MOs

Info

ID:	255981
PubChem CID:	103136051
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	276.103145
ΔH_f, kcal/mol:	-175.77
Dipole, Da:	3.52
IP(EA), eV:	-9.15(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxothiolan-3-yl)-3-(5-methyloxolan-2-yl)propanoic acid

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(CC2=CC=CC=C2OC)C(=O)O

DOS

IR

Vibrations