Sample Originator: Andrew Platta.
Data Collection: Peter N. Hortonb
Structure Determination: Peter N. Hortonb and Michael B. Hursthouseb.
Staffordshire Universitya
University of Southamptonb
C36H81N3O12P3Pr
InChI=1/3C12H28OP.3HNO3.Pr/c3*1-10(2)7-14(13,8-11(3)4)9-12(5)6;3*2-1(3)4;/h3*10-12,14H,7-9H2,1-6H3;3*(H-,2,3,4);/q6*-1;+6
| Identification Number: | 10.5258/ecrystals/1240 |
|---|
| Controlled Keywords: | lanthanide coordination, organophosphorus ligands |
|---|
| Date Created: | 06 October 2009 |
|---|
| Deposited On: | 25 Jan 2010 10:31 |
|---|
| Deposited By: | Dr Peter N Horton |
|---|
Depositor Comments
User Refcode:- Pr iBu
Data collection parameters
| Chemical formula | C36 H81 N3 O12 P3 Pr |
| Crystal morphology | Cut Block |
| Crystal system | orthorhombic |
| Space group symbol | P2(1)2(1)2(1) |
| Cell length a | 14.3481(9) |
| Cell length b | 14.4845(9) |
| Cell length c | 23.9651(15) |
| 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 | 65.08 |
| R Factor (Obs) | 0.0781 |
| R Factor (All) | 0.0789 |
| Weighted R Factor (Obs) | 0.1908 |
| Weighted R Factor (All) | 0.1911 |
Citation: Platt, Andrew and Horton, Peter N. and Hursthouse, Michael B. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1240)
Export as: oreChem EndNote BibTeX ASCII Citation
