Geometry & MOs

Info

ID:	328379
PubChem CID:	126704912
Reduced:	N7H11C17 (1)
Stoich.:	A7B11C17 (1)
Weight, g/mol:	314.102842
ΔH_f, kcal/mol:	185.33
Dipole, Da:	1.83
IP(EA), eV:	-9.46(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-phenyl-6-(1,3,5-triazin-2-yl)pyrimidin-4-yl]-1,3,5-triazine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=CC(=C2)C3=NC=NC=N3)C4=NC=NC=N4

DOS

IR

Vibrations