Geometry & MOs

Info

ID:	303926
PubChem CID:	124490889
Reduced:	NOC9H14 (2)
Stoich.:	ABC9D14 (2)
Weight, g/mol:	304.215078
ΔH_f, kcal/mol:	-99.07
Dipole, Da:	2.99
IP(EA), eV:	-9.17(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3S)-3-[(R)-methylamino(phenyl)methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC[C@@H](C1)[C@@H](C2=CC=CC=C2)NC

DOS

IR

Vibrations