Geometry & MOs

Info

ID:	303929
PubChem CID:	124490894
Reduced:	NOC9H14 (2)
Stoich.:	ABC9D14 (2)
Weight, g/mol:	318.230728
ΔH_f, kcal/mol:	-108.61
Dipole, Da:	1.99
IP(EA), eV:	-8.22(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[(1R)-1-anilinopropyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C1CCN(CC1)C(=O)OC(C)(C)C)NC2=CC=CC=C2

DOS

IR

Vibrations