Acta Cryst. (2010). E66, o481  [ doi:10.1107/S1600536810002795 ]

4-Hydroxy-3-nitrophenyl pentanoate

H. Yang

Online 30 January 2010

Key indicators

• Single-crystal X-ray study
• T = 113 K
• Mean (C-C) = 0.002 Å
• R factor = 0.035
• wR factor = 0.100
• Data-to-parameter ratio = 16.7

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT230_ALERT_2_C Hirshfeld Test Diff for    O1     --  N1      ..       6.08 su   
PLAT430_ALERT_2_C Short Inter D...A Contact  O2     ..  O2      ..       2.86 Ang. 
PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) .....          1      
PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L=  0.600         19      
PLAT913_ALERT_3_C Missing # of Very Strong Reflections in FCF ....          3      
PLAT912_ALERT_4_C Missing # of FCF Reflections Above STh/L=  0.600         22      

   0 ALERT level A = In general: serious problem
   0 ALERT level B = Potentially serious problem
   6 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
   3 ALERT type 3 Indicator that the structure quality may be low
   1 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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