[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o488
[ doi:10.1107/S1600536813005771 ]

Ethyl (2E,4E)-5-(3-bromophenylsulfonyl)penta-2,4-dienoate

V. Sabari, U. Sankar, R. Uma and S. Aravindhan


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT230_ALERT_2_C Hirshfeld Test Diff for C12 -- C13 .. 6.4 su PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C11 PLAT360_ALERT_2_C Short C(sp3)-C(sp3) Bond C12 - C13 ... 1.40 Ang. PLAT431_ALERT_2_C Short Inter HL..A Contact Br1 .. O1 . 3.26 Ang. PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 1
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT153_ALERT_1_G The su's on the Cell Axes are Equal .......... 0.00500 Ang. PLAT199_ALERT_1_G Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_G Check the Reported _diffrn_ambient_temperature 293 K PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 10
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 5 ALERT level C = Check. Ensure it is not caused by an omission or oversight 5 ALERT level G = General information/check it is not something unexpected 3 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 4 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 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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