Martin, D.; Sild, S.; Maran, U.; Karelson, M. QSPR Modeling of the Polarizability of Polyaromatic Hydrocarbons and Fullerenes. J. Phys. Chem. C 2008, 112, 13, 4785–4790.

Compound

	ID:	BGP
	Name:	benzo(ghi)perylene
	Description:
	Labels:	Training
	CAS:	191-24-2
	InChi Code:	InChI=1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H

Properties

p_abinitio: Ab initio calculated polarizability [Å^3]

Value	Source or prediction
37.7	experimental value
35.4	Eq2: Main model (Training set)
41.3	Model_nA: Additional model with descriptor - number of atoms (Training set)
33.2	Model_nC: Additional model with descriptor - number of carbon atoms (Training set)

Links to External Resources

Link	Resource description
DTXSID5023908	US EPA CompTox Dashboard