Geometry & MOs

Info

ID:	390290
PubChem CID:	134998325
Reduced:	ON3H13C16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	247.110947
ΔH_f, kcal/mol:	77.31
Dipole, Da:	5.42
IP(EA), eV:	-9.09(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-methylphenyl)-5-phenyl-1,2,4-triazine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=C(N=NC=N2)C3=CC=CC=C3

DOS

IR

Vibrations