Geometry & MOs

Info

ID:	304211
PubChem CID:	124498903
Reduced:	NOC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-88.69
Dipole, Da:	6.48
IP(EA), eV:	-9.19(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-(2-methyl-6-oxo-1H-pyridin-3-yl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=O)N1)[C@@H]2CCCN2C(=O)C

DOS

IR

Vibrations