[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m628
[ doi:10.1107/S1600536813029395 ]

Poly[[mu]-aqua-[mu]5-[2-(2,3,6-tri­chloro­phenyl)acetato]-caesium]

G. Smith


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT242_ALERT_2_C Low Ueq as Compared to Neighbors for ..... C12 Check PLAT342_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0095 Ang. PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 3.530 Check PLAT975_ALERT_2_C Positive Residual Density at 0.50A from O1W . 0.52 eA-3 PLAT975_ALERT_2_C Positive Residual Density at 0.77A from O1W . 0.43 eA-3 PLAT976_ALERT_2_C Negative Residual Density at 0.79A from O1W . -0.60 eA-3 PLAT976_ALERT_2_C Negative Residual Density at 0.85A from O13 . -0.55 eA-3 PLAT976_ALERT_2_C Negative Residual Density at 1.09A from O1W . -0.49 eA-3
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT007_ALERT_5_G Number of Unrefined Donor-H Atoms .............. 2 Why ? PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 9.06 PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 1.62 Ratio PLAT774_ALERT_1_G Suspect X-Y Bond in CIF: CS1 -- CL6 .. 3.71 Ang. PLAT774_ALERT_1_G Suspect X-Y Bond in CIF: CS1 -- CL6 .. 3.65 Ang. PLAT910_ALERT_3_G Missing # of FCF Reflections Below Th(Min) ..... 4 Why ? PLAT960_ALERT_3_G Number of Intensities with I < - 2*sig(I) ... 1
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 8 ALERT level C = Check. Ensure it is not caused by an omission or oversight 8 ALERT level G = General information/check it is not something unexpected 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 7 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 1 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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