[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, o2624
[ doi:10.1107/S1600536812027870 ]

(10E,12E,14E)-9,16-Dioxooctadeca-10,12,14-trienoic acid

L. Bréant, C. Vonthron-Sénécheau, L. Brelot and A. Lobstein


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT919_ALERT_3_B Reflection # Likely Affected by the Beamstop ... 1 PLAT934_ALERT_3_B Number of (Iobs-Icalc)/SigmaW .gt. 10 Outliers . 1
Alert level C PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.2 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 57 PLAT912_ALERT_4_C Missing # of FCF Reflections Above STh/L= 0.600 71 PLAT913_ALERT_3_C Missing # of Very Strong Reflections in FCF .... 6 PLAT918_ALERT_3_C Reflection(s) # with I(obs) much smaller I(calc) 2 PLAT939_ALERT_3_C Large Value of Not (SHELXL) Weight Optimized S . 11.13
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF .... ? PLAT154_ALERT_1_G The su's on the Cell Angles are Equal .......... 0.00400 Deg.
0 ALERT level A = Most likely a serious problem - resolve or explain 2 ALERT level B = A potentially serious problem, consider carefully 6 ALERT level C = Check. Ensure it is not caused by an omission or oversight 2 ALERT level G = General information/check it is not something unexpected 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 1 ALERT type 2 Indicator that the structure model may be wrong or deficient 6 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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