Acta Cryst. (2005). E61, o1100-o1102  [ doi:10.1107/S1600536805008779 ]

4-Methyl-3,5-dinitrobenzoic acid-dimethyl sulfoxide (1/1)

A. V. Trask, M. Abthorpe and W. Jones

Online 25 March 2005

Key indicators

• Single-crystal X-ray study
• T = 180 K
• Mean (C-C) = 0.002 Å
• R factor = 0.041
• wR factor = 0.102
• Data-to-parameter ratio = 15.7

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT230_ALERT_2_C Hirshfeld Test Diff for    O6     -   N2      ..       5.26 su    
PLAT430_ALERT_2_C Short Inter D...A Contact  O5     ..  O5      ..       2.87 Ang.  

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

   0 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
   0 ALERT type 3 Indicator that the structure quality may be low
   0 ALERT type 4 Improvement, methodology, query or suggestion

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