Acta Cryst. (2011). E67, m1335  [ doi:10.1107/S1600536811035380 ]

Bis(acrylonitrile-N)dichlorido(⁴-cycloocta-1,5-diene)ruthenium(II)

H. Chiririwa and R. Meijboom

Online 14 September 2011

Key indicators

• Single-crystal X-ray study
• T = 100 K
• Mean (C-C) = 0.005 Å
• Disorder in main residue
• R factor = 0.033
• wR factor = 0.075
• Data-to-parameter ratio = 18.9

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT912_ALERT_4_C Missing # of FCF Reflections Above STh/L=  0.600          7      

Alert level G
PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF ....          ?
PLAT301_ALERT_3_G Note: Main Residue  Disorder ...................         16 Perc.
PLAT371_ALERT_2_G Long   C(sp2)-C(sp1) Bond  C21    -   C22    ...       1.43 Ang. 
PLAT811_ALERT_5_G No ADDSYM Analysis: Too Many Excluded Atoms ....          !

   0 ALERT level A = Most likely a serious problem - resolve or explain
   0 ALERT level B = A potentially serious problem, consider carefully
   1 ALERT level C = Check. Ensure it is not caused by an omission or oversight
   4 ALERT level G = General information/check it is not something unexpected

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

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