Geometry & MOs

Info

ID:	302258
PubChem CID:	124360914
Reduced:	ON2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	348.14337
ΔH_f, kcal/mol:	-33.18
Dipole, Da:	7.11
IP(EA), eV:	-9.03(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2N1CCC(=O)N3C[C@H]4C[C@@H](C3)C5=CC=CC(=O)N5C4

DOS

IR

Vibrations