[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, o2815
[ doi:10.1107/S1600536812036756 ]

(E)-4-(2-Hydroxy-3-methoxybenzylideneamino)-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one

B. Shirinkam, M. Tabatabaee, M. Gassemzadeh and B. Neumuller


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT026_ALERT_3_B Ratio Observed / Unique Reflections too Low .... 32 Perc.
Alert level C GOODF01_ALERT_2_C The least squares goodness of fit parameter lies outside the range 0.80 <> 2.00 Goodness of fit given = 0.687 RINTA01_ALERT_3_C The value of Rint is greater than 0.12 Rint given 0.168 PLAT340_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0096 Ang PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 29.383 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.357 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 7.377 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.400 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 2
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF .... ? PLAT007_ALERT_5_G Note: Number of Unrefined D-H Atoms ............ 2 PLAT908_ALERT_2_G Max. Perc. Data with I .gt. 2*s(I) per Res.Shell 74.04 Perc. PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 8
0 ALERT level A = Most likely a serious problem - resolve or explain 1 ALERT level B = A potentially serious problem, consider carefully 8 ALERT level C = Check. Ensure it is not caused by an omission or oversight 4 ALERT level G = General information/check it is not something unexpected 0 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 8 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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