C~15~H~9~N - C15H9N

Sample Originator: Ian R. Butlera.

Data Collection: Peter N. Hortonb and Michael B. Hursthouseb

Structure Determination: Peter N. Hortonb.

University College of North Walesa
University of Southamptonb



Controlled Keywords:organic compounds
Date Created:08 November 2005
Deposited On:14 Aug 2013 23:04
Deposited By:Mr Steve Lamond

Depositor Comments

All hydrogen atoms were fixed.

Data collection parameters

Chemical formulaC15 H9 N
Crystal morphologyRod
Crystal systemOrthorhombic
Space group symbolP2(1)2(1)2(1)
Cell length a3.83960(10)
Cell length b15.1075(8)
Cell length c17.1516(7)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0558
R Factor (Obs)0.0479
R Factor (All)0.0641
Weighted R Factor (Obs)0.1035
Weighted R Factor (All)0.1115

Citation: Butler, Ian R. and Horton, Peter N. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1111/)
Export as: oreChem EndNote BibTeX ASCII Citation

Repository Staff Only: item control page