Geometry & MOs

Info

ID:	292810
PubChem CID:	117359232
Reduced:	O2N5H9C11 (1)
Stoich.:	A2B5C9D11 (1)
Weight, g/mol:	243.075625
ΔH_f, kcal/mol:	-4.84
Dipole, Da:	6.77
IP(EA), eV:	-8.77(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]-1H-quinoxalin-2-one

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1C3=C(NN=C3)N)NC(=O)C(=O)N2

DOS

IR

Vibrations