Geometry & MOs

Info

ID:	258884
PubChem CID:	103157335
Reduced:	NO2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	228.183778
ΔH_f, kcal/mol:	-155.68
Dipole, Da:	8.67
IP(EA), eV:	-9.14(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-cyclopentyl-2-hydroxypropyl)amino]butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)[C@@H]1CC2=CC=CC=C2N1

DOS

IR

Vibrations