Acta Cryst. (2009). E65, m255-m256  [ doi:10.1107/S1600536809003572 ]

1,3-Benzothiazolium tetrachloridoaurate(III) tetrahydrofuran solvate

T. K. Hagos, S. D. Nogai, L. Dobrzanska, S. Cronje and H. G. Raubenheimer

Online 6 February 2009

Key indicators

• Single-crystal X-ray study
• T = 100 K
• Mean (C-C) = 0.007 Å
• R factor = 0.027
• wR factor = 0.064
• Data-to-parameter ratio = 20.0

checkCIF/PLATON results

No syntax errors found




Alert level C
            Value of measurement temperature given =   100.000
            Value of melting point given =     0.000
PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density ....       2.26      
PLAT431_ALERT_2_C Short Inter HL..A Contact  Cl1    ..  S13     ..       3.31 Ang. 
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT480_ALERT_4_C Long H...A H-Bond Reported H8     ..  CL4     ..       2.93 Ang. 
PLAT480_ALERT_4_C Long H...A H-Bond Reported H9     ..  CL4     ..       3.00 Ang. 
PLAT480_ALERT_4_C Long H...A H-Bond Reported H10    ..  CL2     ..       2.96 Ang. 
PLAT480_ALERT_4_C Long H...A H-Bond Reported H11    ..  CL2     ..       2.90 Ang. 
PLAT480_ALERT_4_C Long H...A H-Bond Reported H15B   ..  CL1     ..       3.02 Ang. 
PLAT480_ALERT_4_C Long H...A H-Bond Reported H18A   ..  CL4     ..       2.91 Ang. 

Alert level G
PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints .......          1      

   0 ALERT level A = In general: serious problem
   0 ALERT level B = Potentially serious problem
   9 ALERT level C = Check and explain
   1 ALERT level G = General alerts; check

   1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   2 ALERT type 2 Indicator that the structure model may be wrong or deficient
   1 ALERT type 3 Indicator that the structure quality may be low
   6 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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