Geometry & MOs

Info

ID:	328697
PubChem CID:	126726595
Reduced:	NO2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	283.189592
ΔH_f, kcal/mol:	-213.56
Dipole, Da:	5.79
IP(EA), eV:	-9.58(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-1-[(2S)-2-(2,2-dimethylpropanoylamino)propanoyl]-3-methylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1C[C@H](C[C@H]1C(=O)C)O)NC(=O)C(C)(C)C

DOS

IR

Vibrations