Sample Originator: Scott S. Turnera.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb.
University of Surreya
University of Southamptonb
C14H8CuN4S2
InChI=1/C5H5N.C2H3NS.Cu/c1-2-4-6-5-3-1;3-1-2-4;/h1-5H;4H,2H2;/q;;+1/p-1
| Controlled Keywords: | conductors |
|---|
| Date Created: | 03 November 2005 |
|---|
| Deposited On: | 17 Feb 2010 13:53 |
|---|
| Deposited By: | Mr Steve Lamond |
|---|
Data collection parameters
| Chemical formula | C14 H8 Cu N4 S2 |
| Crystal morphology | Needle |
| Crystal system | orthorhombic |
| Space group symbol | Pbcn |
| Cell length a | 7.52250(10) |
| Cell length b | 24.7605(7) |
| Cell length c | 7.5372(2) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 90.00 |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0808 |
| R Factor (Obs) | 0.0291 |
| R Factor (All) | 0.0341 |
| Weighted R Factor (Obs) | 0.0689 |
| Weighted R Factor (All) | 0.0717 |
Citation: Turner, Scott S. and Horton, Peter N. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1169/)
Export as: oreChem EndNote BibTeX ASCII Citation
