Geometry & MOs

Info

ID:	269619
PubChem CID:	103618215
Reduced:	NOC9H17 (2)
Stoich.:	ABC9D17 (2)
Weight, g/mol:	416.09607
ΔH_f, kcal/mol:	-151.73
Dipole, Da:	3.66
IP(EA), eV:	-8.85(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-(3-iodo-4-methylanilino)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC1CCCCC1NC2CCN(CC2)C(=O)OC(C)(C)C

DOS

IR

Vibrations