Geometry & MOs

Info

ID:	227115
PubChem CID:	87560237
Reduced:	N2O9C11H20 (1)
Stoich.:	A2B9C11D20 (1)
Weight, g/mol:	326.039499
ΔH_f, kcal/mol:	-373.68
Dipole, Da:	5.8
IP(EA), eV:	-9.71(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dioxopyrrolidin-1-yl) 2-(pyridin-2-yldisulfanyl)butanoate

Drug info:

PubChemData

Smile

C(C[C@@H](C(=O)O)N)CN.C(C(C(C(=O)C(=O)C(=O)O)O)O)O

DOS

IR

Vibrations