Hexabenzocoronene

Hexabenzocoronene

Names
Systematic IUPAC name Hexabenzo[bc,de,gh,kl,no,qr]coronene
Identifiers
CAS Number	190-24-9
ChemSpider	119779
Jmol interactive 3D	Image
PubChem	136001
InChI InChI=1S/C42H20/c1-7-19-21-9-2-11-23-25-13-4-15-27-29-17-6-18-30-28-16-5-14-26-24-12-3-10-22-20(8-1)31(19)37-38(32(21)23)40(34(25)27)42(36(29)30)41(35(26)28)39(37)33(22)24/h1-17,35H,18H2 Key: FYXBXZBCUROVBE-UHFFFAOYSA-N
SMILES C12=C3C4=C5C(C6=C7C8=CC=C9)=C1C8=C9C%10=CC=CC(C%11=C3C(C%12=C4C(C(C5%13)=CC=CC%13=C6CC=C7)=CC=C%12)=CC=C%11)=C%102
Properties
Chemical formula	C42H18
Molar mass	522.61 g·mol^−1
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Infobox references

Hexabenzocoronene refers to 2 polycyclic aromatic hydrocarbons with the molecular formula C₄₂H₁₈ and C₄₈H₂₄. They both consist of a central coronene molecule surrounded by 6 fused benzene rings.

The [bc,ef,hi,kl,no,qr] analogue (shown right) has been imaged by atomic force microscopy providing the first example of a molecule in which disparities in bond order and bond lengths of the individual bonds can be distinguished.^[1]

References

1. Gross, L.; Mohn, F.; Moll, N.; Schuler, B.; Criado, A.; Guitian, E.; Pena, D.; Gourdon, A.; Meyer, G. (2012). "Bond-Order Discrimination by Atomic Force Microscopy". Science 337 (6100): 1326–9. doi:10.1126/science.1225621. PMID 22984067.

External links

• Media related to Hexabenzocoronene at Wikimedia Commons