Geometry & MOs

Info

ID:	449407
PubChem CID:	135298322
Reduced:	N3H39C58 (1)
Stoich.:	A3B39C58 (1)
Weight, g/mol:	625.251798
ΔH_f, kcal/mol:	282.1
Dipole, Da:	0.32
IP(EA), eV:	-8.8(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(9,9-diphenylfluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)C3=NC(=NC(=N3)C4=CC=C(C=C4)C5=C6C7=CC=CC=C7C(C6=CC=C5)(C8=CC=CC=C8)C9=CC=CC=C9)C1=CC=CC(=C1)C1=CC=CC=C1

DOS

IR

Vibrations