Geometry & MOs

Info

ID:	278041
PubChem CID:	103832938
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	255.194677
ΔH_f, kcal/mol:	-79.0
Dipole, Da:	2.84
IP(EA), eV:	-9.24(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-2-amino-3-methyl-N-(2-oxo-2-piperidin-1-ylethyl)pentanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNC(=O)C2CC(CN2)OC

DOS

IR

Vibrations