Geometry & MOs

Info

ID:	302297
PubChem CID:	124361132
Reduced:	SN3O5C21H27 (1)
Stoich.:	AB3C5D21E27 (1)
Weight, g/mol:	405.164833
ΔH_f, kcal/mol:	-210.45
Dipole, Da:	6.85
IP(EA), eV:	-8.94(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CSC[C@@H](C(=O)O)NC(=O)CCCCCN1C(=O)[C@H]2CC3=CC=CC=C3CN2C1=O

DOS

IR

Vibrations