Geometry & MOs

Info

ID:	350088
PubChem CID:	127276961
Reduced:	SN3O3C18H33 (1)
Stoich.:	AB3C3D18E33 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-155.09
Dipole, Da:	8.74
IP(EA), eV:	-8.6(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-5-[[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCN(C1CCS(=O)(=O)C1)C(=O)CN2CCCC2CN3CCCCC3

DOS

IR

Vibrations