Geometry & MOs

Info

ID:	270655
PubChem CID:	103637486
Reduced:	SO2N3C17H29 (1)
Stoich.:	AB2C3D17E29 (1)
Weight, g/mol:	319.225977
ΔH_f, kcal/mol:	-105.12
Dipole, Da:	2.4
IP(EA), eV:	-8.78(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[1-(pyridin-2-ylmethylamino)ethyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CNC(C)C2CCCN(C2)C(=O)OC(C)(C)C

DOS

IR

Vibrations