Geometry & MOs

Info

ID:	79153
PubChem CID:	49747139
Reduced:	O2N6C13H16 (1)
Stoich.:	A2B6C13D16 (1)
Weight, g/mol:	293.12766
ΔH_f, kcal/mol:	44.8
Dipole, Da:	1.99
IP(EA), eV:	-9.93(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-benzylazetidin-3-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCNC(=O)CN1CC(C1)C2=NC(=NO2)C3=NC=CN=C3

DOS

IR

Vibrations