Geometry & MOs

Info

ID:	357549
PubChem CID:	127294212
Reduced:	S2N3O5C14H25 (1)
Stoich.:	A2B3C5D14E25 (1)
Weight, g/mol:	349.149384
ΔH_f, kcal/mol:	-224.08
Dipole, Da:	3.86
IP(EA), eV:	-8.58(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propyl-N-(2-thiomorpholin-4-ylsulfonylethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CCC(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations