[Open access]

[Contents scheme]

Acta Cryst. (2014). E70, m162-m163
[ doi:10.1107/S1600536814006060 ]

Bis[2,6-bis­(1H-pyrazol-1-yl)pyridine]­deca­kis­([mu]2-3-nitro­benzoato)bis­(3-nitro­benzoato)tetra­dysprosium(III): a linear tetra­nuclear dysprosium compound based on mixed N- and O-donor ligands

R. Hua, X.-L. Wu and J.-Y. Li


Key indicators

checkCIF/PLATON results

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Alert level B PLAT919_ALERT_3_B Reflection # Likely Affected by the Beamstop ... 2 Check PLAT934_ALERT_3_B Number of (Iobs-Icalc)/SigmaW > 10 Outliers .... 3 Check
Alert level C PLAT220_ALERT_2_C Large Non-Solvent O Ueq(max)/Ueq(min) Range 3.5 Ratio PLAT234_ALERT_4_C Large Hirshfeld Difference O11 -- N8 .. 0.17 Ang. PLAT234_ALERT_4_C Large Hirshfeld Difference O23 -- N11 .. 0.19 Ang. PLAT241_ALERT_2_C High Ueq as Compared to Neighbors for ..... O1 Check PLAT241_ALERT_2_C High Ueq as Compared to Neighbors for ..... O18 Check PLAT241_ALERT_2_C High Ueq as Compared to Neighbors for ..... O21 Check PLAT241_ALERT_2_C High Ueq as Compared to Neighbors for ..... C44 Check PLAT242_ALERT_2_C Low Ueq as Compared to Neighbors for ..... Dy1 Check PLAT242_ALERT_2_C Low Ueq as Compared to Neighbors for ..... Dy2 Check PLAT242_ALERT_2_C Low Ueq as Compared to Neighbors for ..... N7 Check PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 18 Why ?
Alert level G PLAT003_ALERT_2_G Number of Uiso or Uij Restrained non-H Atoms ... 4 Why ? PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Dy1 -- O1 .. 6.6 su PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Dy1 -- O2 .. 5.4 su PLAT301_ALERT_3_G Main Residue Disorder ............ Percentage = 11 Note PLAT860_ALERT_3_G Number of Least-Squares Restraints ............. 24 Note PLAT910_ALERT_3_G Missing # of FCF Reflections Below Th(Min) ..... 1 Why ? PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 9 Note
0 ALERT level A = Most likely a serious problem - resolve or explain 2 ALERT level B = A potentially serious problem, consider carefully 11 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 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 11 ALERT type 2 Indicator that the structure model may be wrong or deficient 6 ALERT type 3 Indicator that the structure quality may be low 3 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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