Geometry & MOs

Info

ID:	14879
PubChem CID:	423371
Reduced:	ON3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	203.105862
ΔH_f, kcal/mol:	38.03
Dipole, Da:	1.02
IP(EA), eV:	-9.14(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-2-methyl-5-phenyl-3H-1,2,4-triazine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations