Geometry & MOs

Info

ID:	255980
PubChem CID:	103136045
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	278.151809
ΔH_f, kcal/mol:	-177.67
Dipole, Da:	4.98
IP(EA), eV:	-8.89(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methoxyphenyl)methyl]-3-(5-methyloxolan-2-yl)propanoic acid

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(CC2=CC(=CC=C2)OC)C(=O)O

DOS

IR

Vibrations