Geometry & MOs

Info

ID:	324898
PubChem CID:	126678562
Reduced:	N2O4C21H32 (1)
Stoich.:	A2B4C21D32 (1)
Weight, g/mol:	369.168856
ΔH_f, kcal/mol:	-200.33
Dipole, Da:	8.18
IP(EA), eV:	-9.68(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2S)-3-methyl-2-(quinoline-4-carbonylamino)butanoyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)N1CCC[C@H]1C(O)O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations