Geometry & MOs

Info

ID:	278058
PubChem CID:	103833053
Reduced:	O2N3C13H27 (1)
Stoich.:	A2B3C13D27 (1)
Weight, g/mol:	226.204513
ΔH_f, kcal/mol:	-142.75
Dipole, Da:	2.66
IP(EA), eV:	-9.47(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-3-methylpentan-1-one

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)NCCC(=O)NC(C)(C)C)N

DOS

IR

Vibrations