[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o1679
[ doi:10.1107/S1600536813028389 ]


H. P. Yennawar, L. J. Silverberg, M. J. Minehan and J. Tierney

Key indicators

checkCIF/PLATON results

No syntax errors found

Alert level A PLAT901_ALERT_1_A Cell Parameters in CIF and FCF do not Match .... ! Error
Alert level C PLAT029_ALERT_3_C _diffrn_measured_fraction_theta_full Low ....... 0.974 PLAT125_ALERT_4_C No '_symmetry_space_group_name_Hall' Given ..... Please Do ! PLAT480_ALERT_4_C Long H...A H-Bond Reported H19 .. O3 .. 2.63 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H11 .. O3 .. 2.71 Ang.
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT793_ALERT_4_G The Model has Chirality at C7 (Verify) R
1 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 4 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 0 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 4 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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