Geometry & MOs

Info

ID:	238823
PubChem CID:	93165564
Reduced:	N2O3C17H30 (1)
Stoich.:	A2B3C17D30 (1)
Weight, g/mol:	310.225643
ΔH_f, kcal/mol:	-164.97
Dipole, Da:	2.97
IP(EA), eV:	-8.95(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[(2S)-2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-3-methylbutanoyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)N1CCC[C@H]1C(=O)O)N(C)C2CCCCC2

DOS

IR

Vibrations