Geometry & MOs

Info

ID:	20757
PubChem CID:	585549
Reduced:	O3C13H18 (1)
Stoich.:	A3B13C18 (1)
Weight, g/mol:	222.125594
ΔH_f, kcal/mol:	-134.66
Dipole, Da:	4.8
IP(EA), eV:	-8.89(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4,5,6,7-tetrahydro-1-benzofuran-2-yl)pentanoic acid

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=C(O2)CCCCC(=O)O

DOS

IR

Vibrations