Geometry & MOs

Info

ID:	23635
PubChem CID:	605293
Reduced:	ON4C9H10 (1)
Stoich.:	AB4C9D10 (1)
Weight, g/mol:	190.085461
ΔH_f, kcal/mol:	43.85
Dipole, Da:	2.29
IP(EA), eV:	-9.16(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-methyl-5-phenyl-1,2,4-triazol-3-one

Drug info:

PubChemData

Smile

CN1C(=O)N(C(=N1)C2=CC=CC=C2)N

DOS

IR

Vibrations