Geometry & MOs

Info

ID:	357363
PubChem CID:	127293996
Reduced:	N2S3O5C13H24 (1)
Stoich.:	A2B3C5D13E24 (1)
Weight, g/mol:	377.144299
ΔH_f, kcal/mol:	-228.36
Dipole, Da:	4.97
IP(EA), eV:	-8.64(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-5-oxo-N-(2-thiomorpholin-4-ylsulfonylethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)S(=O)(=O)CC(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations