Geometry & MOs

Info

ID:	217188
PubChem CID:	85087398
Reduced:	SN3O5C14H19 (1)
Stoich.:	AB3C5D14E19 (1)
Weight, g/mol:	341.183838
ΔH_f, kcal/mol:	-136.49
Dipole, Da:	6.83
IP(EA), eV:	-9.89(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-O-tert-butyl 1-O-(2,5-dioxopyrrolidin-1-yl) 2-pentylbutanedioate

Drug info:

PubChemData

Smile

CC(=C)C(=NOC)C(=O)NC1C2N(C1=O)C(C(S2)(C)C)C(=O)O

DOS

IR

Vibrations