Geometry & MOs

Info

ID:	433002
PubChem CID:	135173139
Reduced:	NOPH28C36 (1)
Stoich.:	ABCD28E36 (1)
Weight, g/mol:	554.247047
ΔH_f, kcal/mol:	157.21
Dipole, Da:	4.78
IP(EA), eV:	-8.11(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexa-1,5-dien-1-yl-4-[9-(1,2-dihydropyridin-2-yl)-9-phenylfluoren-2-yl]-6-phenyl-1,3,5-triazine

Drug info:

PubChemData

Smile

C1C(C=CC2=C1C3=CC=CC=C3C2(C4=CC=CC=C4)C5=CC=CC=N5)P(=O)(C6=CC=CC=C6)C7=CC=CC=C7

DOS

IR

Vibrations