[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m673-m674
[ doi:10.1107/S1600536813030249 ]

[6,6'-Bis(1,1-di­methyl­eth­yl)-4,4'-dimethyl-2,2'-methyl­enediphenolato-[kappa]2O,O']di­chlorido­(9H-fluoren-9-ol-[kappa]O)titanium(IV)-fluorene-diethyl ether (1/0.5/1)

A. J. Nielson, C. Shen and J. M. Waters


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT031_ALERT_4_C Refined Extinction Parameter within Range ...... 2.667 Sigma PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.6 Note PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.665 Check PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.596 106
Alert level G FORMU01_ALERT_1_G There is a discrepancy between the atom counts in the _chemical_formula_sum and _chemical_formula_moiety. This is usually due to the moiety formula being in the wrong format. Atom count from _chemical_formula_sum: C46.5 H55 Cl2 O4 Ti1 Atom count from _chemical_formula_moiety: PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ Please Check PLAT045_ALERT_1_G Calculated and Reported Z Differ by ............ 0.50 Ratio PLAT152_ALERT_1_G The Supplied and Calc. Volume s.u. Differ by ... 4 Units PLAT154_ALERT_1_G The su's on the Cell Angles are Equal .......... 0.03000 Deg. PLAT301_ALERT_3_G Main Residue Disorder ............ Percentage = 13 Note PLAT793_ALERT_4_G The Model has Chirality at C25 (Verify) S PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 68 %
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 4 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 5 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 1 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 2 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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