Acta Cryst. (2001). E57, m605-m606  [ doi:10.1107/S1600536801019808 ]

Aqua-di-₂-chloro-bis(diethylenetriamine)dicopper(II) dichloride

R. D. Willett

Key indicators

• Single-crystal X-ray study
• T = 293 K
• Mean (C-C) = 0.015 Å
• R factor = 0.041
• wR factor = 0.116
• Data-to-parameter ratio = 22.0

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


 Alert Level C:



REFLT_03                                                                        
         From the CIF: _diffrn_reflns_theta_max           27.50                 
         From the CIF: _reflns_number_total               2243                  
         TEST2: Reflns within _diffrn_reflns_theta_max                          
         Count of symmetry unique reflns         2405                           
         Completeness (_total/calc)             93.26%                          
          Alert C: < 95% complete                                               

PLAT_030  Alert C Refined Extinction parameter within range ....       3.00 Sigma

PLAT_162  Alert C Missing or Zero su (esd) on y-coordinate for .       CL1

General Notes



ABSTM_02  When printed, the submitted absorption T values will be replaced      
          by the scaled T values. Since the ratio of scaled T's is              
          identical to the ratio of reported T values, the scaling does         
          not imply a change to the absorption corrections used in the          
          study.                                                                
          Ratio of Tmax expected/reported      0.891                            
          Tmax scaled      0.767 Tmin scaled      0.431                         


 0 Alert Level A = Potentially serious problem

 0 Alert Level B = Potential problem

 3 Alert Level C = Please check

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