Geometry & MOs

Info

ID:	324904
PubChem CID:	126678571
Reduced:	N4O4C15H22 (1)
Stoich.:	A4B4C15D22 (1)
Weight, g/mol:	339.125277
ΔH_f, kcal/mol:	-153.02
Dipole, Da:	7.15
IP(EA), eV:	-9.84(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2S)-3-methyl-2-[(2-methyl-1,3-thiazole-4-carbonyl)amino]butanoyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations