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Acta Cryst. (2010). E66, m594  [ doi:10.1107/S1600536810015369 ]

A tetranuclear cobalt(III) cluster with 2-(hydroxymethyl)pyridine ligands

F.-M. Wang, C.-S. Lu, Y.-Z. Li and Q.-J. Meng

Online 30 April 2010


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Alert level C PLAT341_ALERT_3_C Low Bond Precision on C-C Bonds (x 1000) Ang .. 11 PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 1 PLAT042_ALERT_1_C Calc. and Reported MoietyFormula Strings Differ ?
Alert level G REFLT03_ALERT_4_G Please check that the estimate of the number of Friedel pairs is correct. If it is not, please give the correct count in the _publ_section_exptl_refinement section of the submitted CIF. From the CIF: _diffrn_reflns_theta_max 25.99 From the CIF: _reflns_number_total 4018 Count of symmetry unique reflns 2196 Completeness (_total/calc) 182.97% TEST3: Check Friedels for noncentro structure Estimate of Friedel pairs measured 1822 Fraction of Friedel pairs measured 0.830 Are heavy atom types Z>Si present yes PLAT302_ALERT_4_G Note: Anion/Solvent Disorder ................... 5.00 Perc. PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 41 BR1 -CO1 -O1 -C6 101.30 1.60 1.555 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 46 BR1 -CO1 -O1 -CO1 -118.20 1.50 1.555 1.555 1.555 11.455 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 51 BR1 -CO1 -O1 -CO1 -18.00 1.70 1.555 1.555 1.555 2.565
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 3 ALERT level C = Check and explain 5 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 0 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 5 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check

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