Geometry & MOs

Info

ID:	346114
PubChem CID:	127270602
Reduced:	O2N3C8H13 (2)
Stoich.:	A2B3C8D13 (2)
Weight, g/mol:	355.175673
ΔH_f, kcal/mol:	-114.55
Dipole, Da:	5.57
IP(EA), eV:	-9.25(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)N2CCN(CC2)C(=O)CN3CCOCC3

DOS

IR

Vibrations