Acta Cryst. (2004). E60, o831-o832  [ doi:10.1107/S1600536804009080 ]

4-(2,4-Dichlorobenzylamino)-3-phenyl-5-p-tolyl-4H-1,2,4-triazole

H. Petek, I. Senel, O. Bekircan, E. Agar and S. Sasmaz

Online 24 April 2004

Key indicators

• Single-crystal X-ray study
• T = 293 K
• Mean (C-C) = 0.010 Å
• R factor = 0.074
• wR factor = 0.133
• Data-to-parameter ratio = 14.4

checkCIF/PLATON results

No syntax errors found




Alert level B
PLAT026_ALERT_3_B Ratio Observed / Unique Reflections too Low ....         35 Perc. 

Alert level C
RINTA01_ALERT_3_C  The value of Rint is greater than 0.10
            Rint given   0.149
PLAT020_ALERT_3_C The value of Rint is greater than 0.10 .........       0.15       
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C4     -   C5      ..       5.60 su    
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C5     -   C8      ..       5.12 su    
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors ....        C13     
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors ....         C2     
PLAT340_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ...         10       

   0 ALERT level A = In general: serious problem
   1 ALERT level B = Potentially serious problem
   7 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
   4 ALERT type 2 Indicator that the structure model may be wrong or deficient
   4 ALERT type 3 Indicator that the structure quality may be low
   0 ALERT type 4 Improvement, methodology, query or suggestion

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