Geometry & MOs

Info

ID:	369357
PubChem CID:	127332598
Reduced:	S2N3O4C12H23 (1)
Stoich.:	A2B3C4D12E23 (1)
Weight, g/mol:	337.112999
ΔH_f, kcal/mol:	-184.96
Dipole, Da:	6.88
IP(EA), eV:	-8.79(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(hydroxymethyl)-N-(2-thiomorpholin-4-ylsulfonylethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C(=O)NCCS(=O)(=O)N2CCSCC2)CO

DOS

IR

Vibrations