Geometry & MOs

Info

ID:	362525
PubChem CID:	127308096
Reduced:	ON6C18H24 (1)
Stoich.:	AB6C18D24 (1)
Weight, g/mol:	346.146347
ΔH_f, kcal/mol:	55.75
Dipole, Da:	4.95
IP(EA), eV:	-9.03(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrrolidin-1-yl-[1-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2CCCN(C2)CC3=NN=NN3C4=CC=CC=C4

DOS

IR

Vibrations