Geometry & MOs

Info

ID:	79097
PubChem CID:	49746778
Reduced:	ON3H8C10 (2)
Stoich.:	AB3C8D10 (2)
Weight, g/mol:	360.133474
ΔH_f, kcal/mol:	116.52
Dipole, Da:	3.24
IP(EA), eV:	-9.14(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-indol-1-yl-1-[3-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1C(CN1C(=O)C2=CC=C(C=C2)N3C=CC=C3)C4=NC(=NO4)C5=NC=CN=C5

DOS

IR

Vibrations