Geometry & MOs

Info

ID:	345217
PubChem CID:	127268977
Reduced:	O2N5C12H19 (1)
Stoich.:	A2B5C12D19 (1)
Weight, g/mol:	302.149124
ΔH_f, kcal/mol:	-5.36
Dipole, Da:	4.14
IP(EA), eV:	-9.37(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-pyridin-4-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)NC3CC3

DOS

IR

Vibrations