Geometry & MOs

Info

ID:	275150
PubChem CID:	103814140
Reduced:	ON3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	241.215413
ΔH_f, kcal/mol:	-43.5
Dipole, Da:	3.05
IP(EA), eV:	-8.69(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide

Drug info:

PubChemData

Smile

CN1CCC(CC1)CCNC(=O)[C@@H](CC2=CC=CC=C2)N

DOS

IR

Vibrations