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Acta Cryst. (2014). E70, o61  [ doi:10.1107/S1600536813033230 ]

Hexa­kis­(3-chloro-2-methyl­anilinium) cyclo­hexa­phosphate dihydrate

R. Bel Haj Salah, L. Khederi and M. Rzaigui


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checkCIF/PLATON results

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Alert level C PLAT243_ALERT_4_C High 'Solvent' Ueq as Compared to Neighbors of C18 Check PLAT243_ALERT_4_C High 'Solvent' Ueq as Compared to Neighbors of C19 Check PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of C10 Check PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of C17 Check PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.7 Note PLAT340_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0057 Ang. PLAT353_ALERT_3_C Long N-H (N0.87,N1.01A) N3 - H3B ... 1.01 Ang. PLAT905_ALERT_3_C Negative K value in the Analysis of Variance ... -0.099
Alert level G 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 PLAT199_ALERT_1_G Reported _cell_measurement_temperature ..... (K) 293 Check PLAT200_ALERT_1_G Reported _diffrn_ambient_temperature ..... (K) 293 Check PLAT380_ALERT_4_G Incorrectly? Oriented X(sp2)-Methyl Moiety ..... C7 Check PLAT380_ALERT_4_G Incorrectly? Oriented X(sp2)-Methyl Moiety ..... C14 Check PLAT380_ALERT_4_G Incorrectly? Oriented X(sp2)-Methyl Moiety ..... C21 Check PLAT434_ALERT_2_G Short Inter HL..HL Contact Cl1 .. Cl1 . 3.38 Ang. PLAT910_ALERT_3_G Missing # of FCF Reflections Below Th(Min) ..... 1 Why ? PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 5
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 8 ALERT level C = Check. Ensure it is not caused by an omission or oversight 10 ALERT level G = General information/check it is not something unexpected 3 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 2 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 8 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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