Geometry & MOs

Info

ID:	15607
PubChem CID:	445616
Reduced:	SN3O6C10H17 (1)
Stoich.:	AB3C6D10E17 (1)
Weight, g/mol:	307.083806
ΔH_f, kcal/mol:	-275.47
Dipole, Da:	9.32
IP(EA), eV:	-9.74(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@H](C(=O)O)N

DOS

IR

Vibrations