Geometry & MOs

Info

ID:	207256
PubChem CID:	80367597
Reduced:	NO4C15H21 (1)
Stoich.:	AB4C15D21 (1)
Weight, g/mol:	273.157623
ΔH_f, kcal/mol:	-169.46
Dipole, Da:	3.85
IP(EA), eV:	-9.72(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-ethoxybutanoyl)piperidin-4-yl]oxyacetic acid

Drug info:

PubChemData

Smile

CC(CC(=O)NCCC1=CC(=CC=C1)C(=O)O)COC

DOS

IR

Vibrations