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Acta Cryst. (2012). E68, m1537
[ doi:10.1107/S1600536812045072 ]

Tetrakis(triphenylarsane-[kappa]As)silver(I) trifluoroacetate hemihydrate methanol hemisolvate

S. W. Ng


Key indicators

checkCIF/PLATON results

No syntax errors found



Alert level A PLAT924_ALERT_1_A The Reported and Calculated Rho(min) Differ by . 3.76 eA-3
Author Response: The is a false alert; PLATON cannot check twinned structures.
PLAT927_ALERT_1_A Reported and Calculated  wR2 Differ by .........    -0.0978      
Author Response: The is a false alert; PLATON cannot check twinned structures.
PLAT972_ALERT_2_A Large Calcd. Non-Metal Negative Residual Density      -4.18 eA-3 
Author Response: The is a false alert; PLATON cannot check twinned structures.
PLAT972_ALERT_2_A Large Calcd. Non-Metal Negative Residual Density      -3.55 eA-3 
Author Response: The is a false alert; PLATON cannot check twinned structures.
PLAT974_ALERT_2_A Large Calcd. Negative Residual Density on    Ag1      -4.32 eA-3 
Author Response: The is a false alert; PLATON cannot check twinned structures.

Alert level B PLAT220_ALERT_2_B Large Non-Solvent C Ueq(max)/Ueq(min) ... 4.1 Ratio PLAT926_ALERT_1_B Reported and Calculated R1 Differ by ......... -0.0457 PLAT928_ALERT_1_B Reported and Calculated S value Differ by . -0.870 PLAT971_ALERT_2_B Large Calcd. Non-Metal Positive Residual Density 2.78 eA-3 PLAT971_ALERT_2_B Large Calcd. Non-Metal Positive Residual Density 2.65 eA-3 PLAT971_ALERT_2_B Large Calcd. Non-Metal Positive Residual Density 2.53 eA-3 PLAT972_ALERT_2_B Large Calcd. Non-Metal Negative Residual Density -2.87 eA-3
Author Response: The is a false alert; PLATON cannot check twinned structures.

Alert level C PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C41 PLAT331_ALERT_2_C Small Average Phenyl C-C Dist. C61 -C66 1.37 Ang. PLAT342_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0087 Ang PLAT905_ALERT_3_C Negative K value in the Analysis of Variance ... -0.057 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 83 PLAT925_ALERT_1_C The Reported and Calculated Rho(max) Differ by . 1.70 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 2.48 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 2.15 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 2.14 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 2.07 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 1.71 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 1.65 eA-3 PLAT972_ALERT_2_C Large Calcd. Non-Metal Negative Residual Density -2.39 eA-3
Author Response: The is a false alert; PLATON cannot check twinned structures.
PLAT972_ALERT_2_C Large Calcd. Non-Metal Negative Residual Density      -1.71 eA-3 
Author Response: The is a false alert; PLATON cannot check twinned structures.

Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 22 PLAT003_ALERT_2_G Number of Uiso or Uij Restrained Atom Sites .... 29 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF ... ? PLAT007_ALERT_5_G Note: Number of Unrefined D-H Atoms ............ 3 PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ ? PLAT045_ALERT_1_G Calculated and Reported Z Differ by ............ 0.50 Ratio PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 7.55 PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Ag1 -- As2 .. 7.3 su PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Ag1 -- As3 .. 6.5 su PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Ag1 -- As4 .. 6.8 su PLAT244_ALERT_4_G Low 'Solvent' Ueq as Compared to Neighbors of C74 PLAT244_ALERT_4_G Low 'Solvent' Ueq as Compared to Neighbors of C73' PLAT244_ALERT_4_G Low 'Solvent' Ueq as Compared to Neighbors of C74' PLAT301_ALERT_3_G Note: Main Residue Disorder ................... 16 Perc. PLAT302_ALERT_4_G Note: Anion/Solvent Disorder ................... 100 Perc. PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 3 PLAT811_ALERT_5_G No ADDSYM Analysis: Too Many Excluded Atoms .... ! PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 197 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 170
5 ALERT level A = Most likely a serious problem - resolve or explain 7 ALERT level B = A potentially serious problem, consider carefully 14 ALERT level C = Check. Ensure it is not caused by an omission or oversight 19 ALERT level G = General information/check it is not something unexpected 7 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 24 ALERT type 2 Indicator that the structure model may be wrong or deficient 5 ALERT type 3 Indicator that the structure quality may be low 6 ALERT type 4 Improvement, methodology, query or suggestion 3 ALERT type 5 Informative message, check

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