Acta Cryst. (2006). E62, i234-i235  [ doi:10.1107/S1600536806044321 ]

H₃[AlMo₆(OH)₆O₁₈]·10H₂O

Y. Liu, J.-M. Dou, D.-Q. Wang, X.-X. Zhang and L. Zhou

Online 31 October 2006

Key indicators

• Single-crystal X-ray study
• T = 298 K
• Mean (l-O) = 0.004 Å
• R factor = 0.042
• wR factor = 0.132
• Data-to-parameter ratio = 13.4

checkCIF/PLATON results

No syntax errors found



Datablock: I


Alert level A
PLAT306_ALERT_2_A Isolated Oxygen Atom (H-atoms Missing ?) .......        O13     
PLAT306_ALERT_2_A Isolated Oxygen Atom (H-atoms Missing ?) .......        O14     
PLAT306_ALERT_2_A Isolated Oxygen Atom (H-atoms Missing ?) .......        O15     
PLAT306_ALERT_2_A Isolated Oxygen Atom (H-atoms Missing ?) .......        O16     
PLAT306_ALERT_2_A Isolated Oxygen Atom (H-atoms Missing ?) .......        O17     

Alert level B
PLAT430_ALERT_2_B Short Inter D...A Contact  O1     ..  O10     ..       2.71 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O2     ..  O9      ..       2.83 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O3     ..  O13     ..       2.72 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O4     ..  O14     ..       2.73 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O5     ..  O17     ..       2.61 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O6     ..  O17     ..       2.78 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O8     ..  O16     ..       2.83 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O12    ..  O13     ..       2.79 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O13    ..  O15     ..       2.79 Ang. 
PLAT430_ALERT_2_B Short Inter D...A Contact  O14    ..  O16     ..       2.82 Ang. 

Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT214_ALERT_2_C Atom O13     (Anion/Solvent) ADP max/min Ratio         4.70 prola
PLAT430_ALERT_2_C Short Inter D...A Contact  O12    ..  O14     ..       2.85 Ang. 

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:   Al1 Mo6 O34
            Atom count from _chemical_formula_moiety:H20 Al1 Mo6 O34

   5 ALERT level A = In general: serious problem
  10 ALERT level B = Potentially serious problem
   3 ALERT level C = Check and explain
   1 ALERT level G = General alerts; check

   2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
  17 ALERT type 2 Indicator that the structure model may be wrong or deficient
   0 ALERT type 3 Indicator that the structure quality may be low
   0 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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