Geometry & MOs

Info

ID:	261623
PubChem CID:	103242428
Reduced:	NSO2C16H21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	215.152144
ΔH_f, kcal/mol:	-71.89
Dipole, Da:	4.46
IP(EA), eV:	-9.02(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(oxolan-2-yl)ethylamino]pentanoic acid

Drug info:

PubChemData

Smile

CC(C)CCCNCC1=C(SC2=CC=CC=C21)C(=O)O

DOS

IR

Vibrations