[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, m1570-m1571
[ doi:10.1107/S1600536812048428 ]

Tris(1,10-phenanthroline-[kappa]2N,N')ruthenium(II) bis(perchlorate)

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


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density .... 2.10 PLAT202_ALERT_3_C Isotropic non-H Atoms in Anion/Solvent ......... 4 PLAT221_ALERT_2_C Large Solvent/Anion O Ueq(max)/Ueq(min) ... 4.3 Ratio PLAT221_ALERT_2_C Large Solvent/Anion O Ueq(max)/Ueq(min) ... 4.3 Ratio PLAT342_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0104 Ang PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 8 PLAT918_ALERT_3_C Reflection(s) # with I(obs) much smaller I(calc) 2 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 2.44 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 2.07 eA-3
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 20 PLAT003_ALERT_2_G Number of Uiso or Uij Restrained Atom Sites .... 14 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ ? PLAT072_ALERT_2_G SHELXL First Parameter in WGHT Unusually Large. 0.12 PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 53.73 PLAT244_ALERT_4_G Low 'Solvent' Ueq as Compared to Neighbors of ClBA PLAT302_ALERT_4_G Note: Anion/Solvent Disorder ................... 67 Perc. PLAT311_ALERT_2_G Isolated Disordered Oxygen Atom (No H's ?) ..... O3BA PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 21 PLAT780_ALERT_1_G Coordinates do not Form a Properly Connected Set ? PLAT790_ALERT_4_G Centre of Gravity not Within Unit Cell: Resd. # 3 Cl O4 PLAT811_ALERT_5_G No ADDSYM Analysis: Too Many Excluded Atoms .... ! PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 181 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 2
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 9 ALERT level C = Check. Ensure it is not caused by an omission or oversight 15 ALERT level G = General information/check it is not something unexpected 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 10 ALERT type 2 Indicator that the structure model may be wrong or deficient 5 ALERT type 3 Indicator that the structure quality may be low 5 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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