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[Contents scheme]

Acta Cryst. (2012). E68, m1215
[ doi:10.1107/S1600536812036458 ]

{2,2'-[Cyclohexane-1,2-diylbis(nitrilomethanylylidene)]diphenolato}copper(II)

S. Zhao, X. Lü and X. Liu


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT026_ALERT_3_B Ratio Observed / Unique Reflections too Low .... 37 Perc. PLAT341_ALERT_3_B Low Bond Precision on C-C Bonds ............... 0.0158 Ang PLAT919_ALERT_3_B Reflection # Likely Affected by the Beamstop ... 1 PLAT934_ALERT_3_B Number of (Iobs-Icalc)/SigmaW .gt. 10 Outliers . 1
Alert level C RINTA01_ALERT_3_C The value of Rint is greater than 0.12 Rint given 0.154 PLAT020_ALERT_3_C The value of Rint is greater than 0.12 ......... 0.154 PLAT234_ALERT_4_C Large Hirshfeld Difference C8 -- C13 .. 0.16 Ang. PLAT234_ALERT_4_C Large Hirshfeld Difference C10 -- C11 .. 0.18 Ang. PLAT234_ALERT_4_C Large Hirshfeld Difference C11 -- C12 .. 0.20 Ang. PLAT234_ALERT_4_C Large Hirshfeld Difference C15 -- C16 .. 0.17 Ang. PLAT234_ALERT_4_C Large Hirshfeld Difference C18 -- C19 .. 0.20 Ang. PLAT234_ALERT_4_C Large Hirshfeld Difference C35 -- C40 .. 0.16 Ang. PLAT234_ALERT_4_C Large Hirshfeld Difference C36 -- C37 .. 0.16 Ang. PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C35 PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.1 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 23.960 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 4.588 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.597 29 PLAT918_ALERT_3_C Reflection(s) # with I(obs) much smaller I(calc) 1
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF .... ? PLAT793_ALERT_4_G The Model has Chirality at C8 (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C13 (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C21 (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C26 (Verify) .... R
0 ALERT level A = Most likely a serious problem - resolve or explain 4 ALERT level B = A potentially serious problem, consider carefully 15 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 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 2 ALERT type 2 Indicator that the structure model may be wrong or deficient 10 ALERT type 3 Indicator that the structure quality may be low 11 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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