Geometry & MOs

Info

ID:	293888
PubChem CID:	117410122
Reduced:	O4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	262.120509
ΔH_f, kcal/mol:	-139.36
Dipole, Da:	5.93
IP(EA), eV:	-8.73(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-3-(5-methoxy-1,3-dihydro-2-benzofuran-4-yl)propanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1OCCO2)C(CC(=O)O)C3CC3

DOS

IR

Vibrations