Geometry & MOs

Info

ID:	348001
PubChem CID:	127273063
Reduced:	SN3O3C18H31 (1)
Stoich.:	AB3C3D18E31 (1)
Weight, g/mol:	362.141262
ΔH_f, kcal/mol:	-140.91
Dipole, Da:	6.38
IP(EA), eV:	-8.73(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]thiolane 1,1-dioxide

Drug info:

PubChemData

Smile

C1CCC(=CC1)CCNC(=O)CN2CCN(CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations