Geometry & MOs

Info

ID:	225343
PubChem CID:	85756495
Reduced:	NO3H13C15 (2)
Stoich.:	AB3C13D15 (2)
Weight, g/mol:	262.121846
ΔH_f, kcal/mol:	-63.41
Dipole, Da:	3.6
IP(EA), eV:	-9.71(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-phenyl-4H-triazolo[1,5-a]quinoxaline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CON=NOCC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations