Geometry & MOs

Info

ID:

368798

PubChem CID:

127330140

Reduced:

ON2C11H14 (2)

Stoich.:

AB2C11D14 (2)

Weight, g/mol:

341.115775

ΔHf, kcal/mol:

-51.34

Dipole, Da:

4.93

IP(EA), eV:

-8.77(0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[1-(1-methylpyrazol-4-yl)-2-oxopyrrolidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CCC1=CC(=NC=N1)N2CCCC(C2)NC(=O)CC3CCOC4=CC=CC=C34

DOS

IR

Vibrations