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Acta Cryst. (2006). E62, i155-i157 [ doi:10.1107/S1600536806023038 ]
Redetermination of Mn1.44Mo8O11: evidence of pairwise distortion of octahedral molybdenum chains
Online 23 June 2006
Key indicators
- Single-crystal X-ray study
- T = 293 K
- Mean
![[sigma]](http://journals.iucr.org/logos/entities/sigma_rmgif.gif)
(o-Mo) = 0.000 Å
- Disorder in main residue
- R factor = 0.033
- wR factor = 0.076
- Data-to-parameter ratio = 32.1
checkCIF/PLATON results
No syntax errors found
Alert level B
PLAT110_ALERT_2_B ADDSYM Detects Potential Lattice Centering or Halving . ?
Alert level C
PLAT041_ALERT_1_C Calc. and Rep. SumFormula Strings Differ .... ?
PLAT045_ALERT_1_C Calculated and Reported Z Differ by ............ 0.25 Ratio
PLAT077_ALERT_4_C Unitcell contains non-integer number of atoms .. ?
PLAT199_ALERT_1_C Check the Reported _cell_measurement_temperature 293 K
PLAT200_ALERT_1_C Check the Reported _diffrn_ambient_temperature . 293 K
PLAT301_ALERT_3_C Main Residue Disorder ......................... 6.00 Perc.
PLAT779_ALERT_2_C Suspect or Irrelevant (Bond) Angle in CIF ...... 28.62 Deg.
MN2 -O4 -MN1 1.455 1.555 1.455
PLAT779_ALERT_2_C Suspect or Irrelevant (Bond) Angle in CIF ...... 28.40 Deg.
MN1 -O8 -MN2 1.555 1.555 1.555
PLAT779_ALERT_2_C Suspect or Irrelevant (Bond) Angle in CIF ...... 26.77 Deg.
MN2 -O9 -MN1 1.455 1.555 1.455
0 ALERT level A = In general: serious problem
1 ALERT level B = Potentially serious problem
9 ALERT level C = Check and explain
0 ALERT level G = General alerts; check
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
1 ALERT type 3 Indicator that the structure quality may be low
1 ALERT type 4 Improvement, methodology, query or suggestion
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