Geometry & MOs

Info

ID:	351552
PubChem CID:	127280444
Reduced:	O3N4C17H28 (1)
Stoich.:	A3B4C17D28 (1)
Weight, g/mol:	335.19574
ΔH_f, kcal/mol:	-144.89
Dipole, Da:	3.39
IP(EA), eV:	-8.9(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-[4-(2-pyrrolidin-1-ylacetyl)piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(=O)N1CCCC1C(=O)N2CCN(CC2)C(=O)CN3CCCC3

DOS

IR

Vibrations