Geometry & MOs

Info

ID:	270068
PubChem CID:	103625898
Reduced:	NO2C8H16 (2)
Stoich.:	AB2C8D16 (2)
Weight, g/mol:	344.132527
ΔH_f, kcal/mol:	-212.86
Dipole, Da:	3.05
IP(EA), eV:	-9.0(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[1-(5-chlorothiophen-2-yl)ethylamino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC(C1)NCCCOCCOC

DOS

IR

Vibrations