[Open access]

Acta Cryst. (2013). E69, i7
[ doi:10.1107/S1600536813000731 ]

The defect scheelite-type lanthanum(III) ortho-oxidomolybdate(VI) La0.667[MoO4]

T. Schustereit, T. Schleid and I. Hartenbach


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: LA -- LA .. 4.01 Ang. PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: LA -- LA .. 4.01 Ang. PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: LA -- LA .. 4.01 Ang. PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: LA -- LA .. 4.01 Ang.
Alert level C PLAT041_ALERT_1_C Calc. and Reported SumFormula Strings Differ ? PLAT068_ALERT_1_C Reported F000 Differs from Calcd (or Missing)... ? PLAT077_ALERT_4_C Unitcell contains non-integer number of atoms .. ? PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 6.690 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 3.420
Alert level G PLAT004_ALERT_5_G Info: Polymeric Structure Found with Dimension . 3 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT045_ALERT_1_G Calculated and Reported Z Differ by ............ 0.25 Ratio PLAT199_ALERT_1_G Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_G Check the Reported _diffrn_ambient_temperature 293 K PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mo -- O .. 7.0 su PLAT301_ALERT_3_G Note: Main Residue Disorder ................... 20 Perc. PLAT794_ALERT_5_G Note: Tentative Bond Valency for Mo (VI) 5.94 PLAT811_ALERT_5_G No ADDSYM Analysis: Too Many Excluded Atoms .... !
0 ALERT level A = Most likely a serious problem - resolve or explain 4 ALERT level B = A potentially serious problem, consider carefully 5 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 9 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 3 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion 4 ALERT type 5 Informative message, check

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