Geometry & MOs

Info

ID:	275081
PubChem CID:	103813691
Reduced:	OSN3C11H21 (1)
Stoich.:	ABC3D11E21 (1)
Weight, g/mol:	259.135448
ΔH_f, kcal/mol:	-53.8
Dipole, Da:	2.67
IP(EA), eV:	-8.59(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-N-(2-thiomorpholin-4-ylethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](NC1)C(=O)NCCN2CCSCC2

DOS

IR

Vibrations