Geometry & MOs

Info

ID:	13350
PubChem CID:	226603
Reduced:	O4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	262.120509
ΔH_f, kcal/mol:	-167.24
Dipole, Da:	4.93
IP(EA), eV:	-9.99(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-cyclopentylpropanoyloxy)benzoic acid

Drug info:

PubChemData

Smile

C1CCC(C1)CCC(=O)OC2=CC=CC=C2C(=O)O

DOS

IR

Vibrations