Geometry & MOs

Info

ID:	303918
PubChem CID:	124490876
Reduced:	NOC9H14 (2)
Stoich.:	ABC9D14 (2)
Weight, g/mol:	304.215078
ΔH_f, kcal/mol:	-101.81
Dipole, Da:	4.39
IP(EA), eV:	-8.66(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3R)-3-[(1R)-1-anilinoethyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC[C@H]1[C@H](C2=CC=CC=C2)NC

DOS

IR

Vibrations