Geometry & MOs

Info

ID:	137040
PubChem CID:	52142941
Reduced:	SN3O3C12H19 (1)
Stoich.:	AB3C3D12E19 (1)
Weight, g/mol:	285.114713
ΔH_f, kcal/mol:	-75.49
Dipole, Da:	2.98
IP(EA), eV:	-8.83(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[[5-[(2S)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]morpholine

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)C2=NN=C(O2)SCCN3CCOCC3

DOS

IR

Vibrations