Geometry & MOs

Info

ID:	230271
PubChem CID:	87570551
Reduced:	ClSO2N3H12C16 (1)
Stoich.:	ABC2D3E12F16 (1)
Weight, g/mol:	312.168522
ΔH_f, kcal/mol:	12.12
Dipole, Da:	6.57
IP(EA), eV:	-9.2(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dioxopyrrolidin-1-yl) 2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)NC2=C(N=CC(=C2)C3=CN=CC=C3)Cl

DOS

IR

Vibrations