[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, o3171
[ doi:10.1107/S1600536812042791 ]

3-tert-Butyl-1-(3-nitrophenyl)-1H-pyrazol-5-amine

S. Hernández-Ortega, F. Cuenú-Cabezas, R. Abonia-González and A. Cabrera-Ortiz


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT230_ALERT_2_C Hirshfeld Test Diff for N3 -- C13 .. 5.2 su PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for N3 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 3.415 PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 1
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 3 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF .... ? PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 2
0 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 3 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 0 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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