[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o1801
[ doi:10.1107/S1600536813031383 ]

1-Octylindoline-2,3-dione

F.-Z. Qachchachi, Y. Kandri Rodi, E. M. Essassi, W. Kunz and L. El Ammari


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT930_ALERT_2_B Check Twin Law ( 1 0 0)[ 5 0 2] Estimated BASF 0.12
Author Response: The refinement performed by using the twin law [1 0 0.834 0 -1 0 0 0 -1] resulted in a BASF parameter converging to 0.0000(4)

Alert level C PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density .... 2.19 PLAT369_ALERT_2_C Long C(sp2)-C(sp2) Bond C1 - C2 ... 1.56 Ang. PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 3.185 Check PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 4
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT870_ALERT_4_G ALERTS Related to Twinning Effects Suppressed .. ! Info PLAT870_ALERT_4_G ALERTS Related to Twinning Effects Suppressed .. ! Info 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 48 PLAT931_ALERT_5_G Check Twin Law ( 1 0 0)[ ] Estimated BASF 0.12
0 ALERT level A = Most likely a serious problem - resolve or explain 1 ALERT level B = A potentially serious problem, consider carefully 4 ALERT level C = Check. Ensure it is not caused by an omission or oversight 6 ALERT level G = General information/check it is not something unexpected 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 3 ALERT type 2 Indicator that the structure model may be wrong or deficient 3 ALERT type 3 Indicator that the structure quality may be low 3 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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