Geometry & MOs

Info

ID:	198673
PubChem CID:	79135231
Reduced:	NOSC16H27 (1)
Stoich.:	ABCD16E27 (1)
Weight, g/mol:	172.157563
ΔH_f, kcal/mol:	-56.14
Dipole, Da:	2.54
IP(EA), eV:	-8.99(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-aminoethyl)-1-ethylpiperidin-4-ol

Drug info:

PubChemData

Smile

CC(C)C1CCC(CC1)(CN)C(C)(C2=CC=CS2)O

DOS

IR

Vibrations