Acta Cryst. (2001). E57, m459-m461  [ doi:10.1107/S1600536801014568 ]

trans-Dichloro(meso-2,3,7,11,12-pentamethyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene-⁴N^3,7,11,17)rhodium(III) hexafluorophosphate

A. J. Blake, T. I. Hyde and M. Schröder

Online 20 September 2001

Key indicators

• Single-crystal X-ray study
• T = 293 K
• Mean (C-C) = 0.016 Å
• Disorder in solvent or counterion
• R factor = 0.065
• wR factor = 0.182
• Data-to-parameter ratio = 9.5

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


 Alert Level A:



THETM_01  Alert A The value of sine(theta_max)/wavelength is less than 0.550    
          Calculated sin(theta_max)/wavelength =    0.5378                      


 Alert Level C:



ABSTM_02  Alert C The ratio of expected to reported Tmax/Tmin(RR') is < 0.90    
          Tmin and Tmax reported:      0.448     0.898                          
          Tmin' and Tmax expected:      0.581     0.898                         
          RR' =      0.771                                                      
          Please check that your absorption correction is appropriate.          

REFNR_01  Alert C Ratio of reflections to parameters is < 10 for a              
          centrosymmetric structure                                             
          sine(theta)/lambda                0.5378                              
          Proportion of unique data used    0.9987                              
          Ratio reflections to parameters   9.5200                              

PLAT_302  Alert C Anion/Solvent Disorder .......................      36.00 Perc.

General Notes



ABSTY_01  Extra text has been found in the _exptl_absorpt_correction_type       
          field, which should be only a single keyword. A literature            
          citation should be included in the _exptl_absorpt_process_details     
          field.                                                                


 1 Alert Level A = Potentially serious problem

 0 Alert Level B = Potential problem

 3 Alert Level C = Please check

Copyright © International Union of Crystallography
IUCr Webmaster