[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, m1414-m1415
[ doi:10.1107/S1600536812043917 ]

Bis(2,2':6',2''-terpyridine)ruthenium(II) bis(perchlorate) hemihydrate

M. Kozlowska, P. Rodziewicz, D. M. Brus, J. Breczko and K. Brzezinski


Key indicators

checkCIF/PLATON results

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Alert level B PLAT934_ALERT_3_B Number of (Iobs-Icalc)/SigmaW .gt. 10 Outliers . 2
Alert level C PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of Cl1A PLAT717_ALERT_1_C D...A Unknown or Inconsistent Label .......... <I>CG</ PLAT717_ALERT_1_C D...A Unknown or Inconsistent Label .......... <I>CG</ PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 4.455 PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 5 PLAT975_ALERT_2_C Positive Residual Density at 1.03A from O4B . 0.60 eA-3 PLAT975_ALERT_2_C Positive Residual Density at 0.85A from O4B . 0.51 eA-3
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 3 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF ... ? PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ ? PLAT045_ALERT_1_G Calculated and Reported Z Differ by ............ 0.50 Ratio PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 7.00 PLAT128_ALERT_4_G Alternate Setting of Space-group P21/c ....... P21/n PLAT302_ALERT_4_G Note: Anion/Solvent Disorder ................... 5 Perc. PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 3 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 3
0 ALERT level A = Most likely a serious problem - resolve or explain 1 ALERT level B = A potentially serious problem, consider carefully 7 ALERT level C = Check. Ensure it is not caused by an omission or oversight 9 ALERT level G = General information/check it is not something unexpected 4 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 4 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 4 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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