Acta Cryst. (2009). E65, m28  [ doi:10.1107/S160053680804083X ]

Bis[3,5-difluoro-2-(2-pyridyl)phenyl](picolinato)iridium(III)

M.-L. Xu, G.-B. Che, X.-Y. Li and Q. Xiao

Online 10 December 2008

Key indicators

• Single-crystal X-ray study
• T = 292 K
• Mean (C-C) = 0.008 Å
• R factor = 0.034
• wR factor = 0.066
• Data-to-parameter ratio = 15.8

checkCIF/PLATON results

No syntax errors found




Alert level C
            Value of measurement temperature given =   292.000
            Value of melting point given =     0.000
PLAT083_ALERT_2_C SHELXL Second Parameter in WGHT unusually Large.      17.00      
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C8     --  C9      ..       5.36 su   
PLAT369_ALERT_2_C Long   C(sp2)-C(sp2) Bond  C23    -   C28    ...       1.53 Ang. 
PLAT066_ALERT_1_C Predicted and Reported Transmissions Identical .          ?
PLAT234_ALERT_4_C Large Hirshfeld Difference C3     --  C4      ..       0.12  Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C6     --  C7      ..       0.13  Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C6     --  C11     ..       0.10  Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C9     --  C10     ..       0.11  Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C10    --  C11     ..       0.12  Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C12    --  C13     ..       0.11  Ang.

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

   1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   3 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
   6 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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