Geometry & MOs

Info

ID:	347041
PubChem CID:	127271545
Reduced:	ON8C13H18 (1)
Stoich.:	AB8C13D18 (1)
Weight, g/mol:	305.160023
ΔH_f, kcal/mol:	65.18
Dipole, Da:	4.65
IP(EA), eV:	-9.13(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(1,2,4-triazol-1-yl)ethyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=NN=CC=C2)C(=O)NCCN3C=NC=N3

DOS

IR

Vibrations