Geometry & MOs

Info

ID:	302282
PubChem CID:	124361067
Reduced:	N4O5C19H24 (1)
Stoich.:	A4B5C19D24 (1)
Weight, g/mol:	406.148849
ΔH_f, kcal/mol:	-203.07
Dipole, Da:	6.65
IP(EA), eV:	-9.09(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2R)-3-methyl-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]butanoyl]amino]butanedioic acid

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)N2CC(=O)NC3=CC=CC=C32

DOS

IR

Vibrations