Geometry & MOs

Info

ID:	438128
PubChem CID:	135227751
Reduced:	BrN3H16C25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	539.09971
ΔH_f, kcal/mol:	148.85
Dipole, Da:	2.0
IP(EA), eV:	-9.11(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC4=CC=CC=C4C=C3)C5=CC(=CC=C5)Br

DOS

IR

Vibrations