(IUCr) Crystallography Journals Online checkcif report

[Contents scheme]

Acta Cryst. (2002). E58, m334-m336 [ doi:10.1107/S1600536802010073 ]

Dichloro(dimethylformamide)[2-hydroxy-5-nitro-N-(8-quinolyl)salicylaldiminato]iron(III)

J.-L. Xie, W.-J. Tong, Y. Zou, X.-M. Ren, Y.-Z. Li and Q.-J. Meng

Online 14 June 2002

Key indicators

Single-crystal X-ray study
T = 293 K
Mean (C-C) = 0.009 Å
R factor = 0.090
wR factor = 0.244
Data-to-parameter ratio = 16.8

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


 Alert Level C:



REFLT_03                                                                        
         From the CIF: _diffrn_reflns_theta_max           28.05                 
         From the CIF: _reflns_number_total               4582                  
         TEST2: Reflns within _diffrn_reflns_theta_max                          
         Count of symmetry unique reflns         4959                           
         Completeness (_total/calc)             92.40%                          
          Alert C: < 95% complete                                               

RINTA_01  Alert C The value of Rint is greater than 0.10                        
          Rint given   0.111                                                    

PLAT_213  Alert C Atom O2      has ADP max/min Ratio ...........       3.50 prolate


 0 Alert Level A = Potentially serious problem

 0 Alert Level B = Potential problem

 3 Alert Level C = Please check