Geometry & MOs

Info

ID:	426355
PubChem CID:	135143559
Reduced:	ON4H30C45 (1)
Stoich.:	AB4C30D45 (1)
Weight, g/mol:	359.08254
ΔH_f, kcal/mol:	209.05
Dipole, Da:	2.14
IP(EA), eV:	-8.68(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-dibenzofuran-1-yl-6-phenyl-1,4-dihydro-1,3,5-triazine

Drug info:

PubChemData

Smile

C1CC=C(C=C1)C2=CC=CC=C2C3=CC4=C(C=C3)C5=CC=CC=C5N4C6=NC(=NC(=N6)C7=C8C9=CC=CC=C9OC8=CC=C7)C1=CC=CC=C1

DOS

IR

Vibrations