Geometry & MOs

Info

ID:	366028
PubChem CID:	127319334
Reduced:	SO2N4C17H20 (1)
Stoich.:	AB2C4D17E20 (1)
Weight, g/mol:	331.156577
ΔH_f, kcal/mol:	-18.99
Dipole, Da:	7.3
IP(EA), eV:	-9.14(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-(4-morpholin-4-yl-1,1-dioxothiolan-3-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCCC1C(=O)N2CSCC2C(=O)NC3=CC=C(C=C3)C#N

DOS

IR

Vibrations