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Acta Cryst. (2005). E61, o2336-o2337  [ doi:10.1107/S1600536805020283 ]

N-Benzoylalanine

A.-Y. Fu and D.-Q. Wang

Online 6 July 2005


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT029_ALERT_3_C _diffrn_measured_fraction_theta_full Low ....... 0.96 PLAT066_ALERT_1_C Predicted and Reported Transmissions Identical . ? PLAT088_ALERT_3_C Poor Data / Parameter Ratio .................... 9.70 PLAT125_ALERT_4_C No _symmetry_space_group_name_Hall Given ....... ? PLAT199_ALERT_1_C Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_C Check the Reported _diffrn_ambient_temperature . 293 K PLAT737_ALERT_1_C D...A Calc 2.6044(19), Rep 2.604(5) ...... 2.63 su-Rat O1 -O3 1.555 2.555 PLAT737_ALERT_1_C D...A Calc 3.076(2), Rep 3.076(5) ...... 2.50 su-Rat N1 -O2 1.555 3.566
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 8 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 5 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 0 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion

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