Acta Cryst. (2008). E64, o977  [ doi:10.1107/S1600536808012580 ]

8-Bromonaphthalen-1-amine

A. L. Fuller, F. R. Knight, A. M. Z. Slawin and J. D. Woollins

Online 3 May 2008

Key indicators

• Single-crystal X-ray study
• T = 125 K
• Mean (C-C) = 0.007 Å
• R factor = 0.052
• wR factor = 0.117
• Data-to-parameter ratio = 13.9

checkCIF/PLATON results

No syntax errors found




Alert level B
PLAT094_ALERT_2_B Ratio of Maximum / Minimum Residual Density ....       4.51      
PLAT230_ALERT_2_B Hirshfeld Test Diff for    C6     -   C7      ..      15.02 su   

Alert level C
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C5     -   C6      ..       6.94 su   
PLAT335_ALERT_2_C Large Benzene C-C Range .......  C5     -C10           0.16 Ang. 
PLAT341_ALERT_3_C Low Bond Precision on C-C Bonds (x 1000) Ang ...          7      

   0 ALERT level A = In general: serious problem
   2 ALERT level B = Potentially serious problem
   3 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
   1 ALERT type 3 Indicator that the structure quality may be low
   0 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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