Geometry & MOs

Info

ID:	240947
PubChem CID:	93618363
Reduced:	NO2C5H9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	230.126657
ΔH_f, kcal/mol:	-186.05
Dipole, Da:	8.71
IP(EA), eV:	-9.93(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[[(2R)-1-methoxypropan-2-yl]carbamoyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C[C@@H](COC)NC(=O)N1CCC[C@H]1C(=O)O

DOS

IR

Vibrations