Geometry & MOs

Info

ID:	274300
PubChem CID:	103808430
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	212.188863
ΔH_f, kcal/mol:	-41.52
Dipole, Da:	2.91
IP(EA), eV:	-8.43(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(3,3-dimethylbutyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CO1)C2=CC=C(C=C2)NC(=O)[C@@H]3CCCCN3

DOS

IR

Vibrations