Geometry & MOs

Info

ID:	258659
PubChem CID:	103156105
Reduced:	N2O4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	264.136159
ΔH_f, kcal/mol:	-202.16
Dipole, Da:	7.34
IP(EA), eV:	-9.69(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-cyclopentyl-2-hydroxypropoxy)benzoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)NCC1CCCCC1C(=O)O)CN

DOS

IR

Vibrations