Geometry & MOs

Info

ID:	349976
PubChem CID:	127276781
Reduced:	OSN6C14H22 (1)
Stoich.:	ABC6D14E22 (1)
Weight, g/mol:	392.107375
ΔH_f, kcal/mol:	50.02
Dipole, Da:	7.79
IP(EA), eV:	-9.05(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]pyrrolidin-2-yl]-thiomorpholin-4-ylmethanone

Drug info:

PubChemData

Smile

C1CC(N(C1)CC2=NN=NN2C3CC3)C(=O)N4CCSCC4

DOS

IR

Vibrations