[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, o3491-o3492
[ doi:10.1107/S1600536812048416 ]

N,N-Bis(diphenylthiophosphinoyl)-4-ethylaniline

P. A. Ajibade, D. C. Onwudiwe and B. Omondi


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT201_ALERT_2_B Isotropic non-H Atoms in Main Residue(s) ....... 1 PLAT220_ALERT_2_B Large Non-Solvent C Ueq(max)/Ueq(min) ... 5.2 Ratio
Alert level C PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density .... 2.25 PLAT222_ALERT_3_C Large Non-Solvent H Uiso(max)/Uiso(min) .. 6.0 Ratio PLAT366_ALERT_2_C Short? C(sp?)-C(sp?) Bond C28 - C29 ... 1.39 Ang. PLAT905_ALERT_3_C Negative K value in the Analysis of Variance ... -0.116 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 32
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 4 PLAT003_ALERT_2_G Number of Uiso or Uij Restrained Atom Sites .... 2 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT154_ALERT_1_G The su's on the Cell Angles are Equal .......... 0.00200 Deg. PLAT242_ALERT_2_G Check Low Ueq as Compared to Neighbors for C31B PLAT301_ALERT_3_G Note: Main Residue Disorder ................... 3 Perc. PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 9 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 112
0 ALERT level A = Most likely a serious problem - resolve or explain 2 ALERT level B = A potentially serious problem, consider carefully 5 ALERT level C = Check. Ensure it is not caused by an omission or oversight 8 ALERT level G = General information/check it is not something unexpected 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 7 ALERT type 2 Indicator that the structure model may be wrong or deficient 5 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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