Geometry & MOs

Info

ID:	336453
PubChem CID:	127255460
Reduced:	BO2H23C32 (1)
Stoich.:	AB2C23D32 (1)
Weight, g/mol:	556.08266
ΔH_f, kcal/mol:	-23.71
Dipole, Da:	3.22
IP(EA), eV:	-8.43(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-bromo-5-fluoranthen-3-ylphenyl)fluoranthene

Drug info:

PubChemData

Smile

B(C1=C2C=CC=CC2=C(C3=CC=CC=C13)C4=CC(=CC(=C4)C5=CC=CC=C5)C6=CC=CC=C6)(O)O

DOS

IR

Vibrations