[HTML version][PDF version][Article Abstract][CIF][3d view][Structure Factors][Supplementary Material][Issue contents]  [Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m416  [ doi:10.1107/S1600536813017121 ]

catena-Poly[(diaquacadmium)-[mu]-iminodiacetato-[kappa]4O,N,O':O'']

G.-H. Pan, J.-N. Tang, Z.-J. Huang, Y.-F. Liao and B.-F. Mo


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT934_ALERT_3_B Number of (Iobs-Icalc)/SigmaW > 10 Outliers .... 3
Alert level C PLAT089_ALERT_3_C Poor Data / Parameter Ratio (Zmax < 18) ..... 6.76 PLAT342_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0200 Ang. PLAT417_ALERT_2_C Short Inter D-H..H-D H5B .. H6A .. 2.10 Ang. PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.969 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.594 3 PLAT915_ALERT_3_C Low Friedel Pair Coverage ...................... 87 % PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 1.77 eA-3 PLAT971_ALERT_2_C Large Calcd. Non-Metal Positive Residual Density 1.51 eA-3 PLAT972_ALERT_2_C Large Calcd. Non-Metal Negative Residual Density -1.51 eA-3 PLAT975_ALERT_2_C Positive Residual Density at 0.84A from O2 . 0.69 eA-3 PLAT975_ALERT_2_C Positive Residual Density at 0.97A from O5 . 0.60 eA-3
Alert level G PLAT004_ALERT_5_G Info: Polymeric Structure Found with Dimension . 1 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? Do ! PLAT007_ALERT_5_G Note: Number of Unrefined Donor-H Atoms ........ 5 PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 9.97 PLAT792_ALERT_1_G Note: The Model has Chirality at N1 (Verify) S PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 78 %
0 ALERT level A = Most likely a serious problem - resolve or explain 1 ALERT level B = A potentially serious problem, consider carefully 11 ALERT level C = Check. Ensure it is not caused by an omission or oversight 6 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 7 ALERT type 3 Indicator that the structure quality may be low 0 ALERT type 4 Improvement, methodology, query or suggestion 3 ALERT type 5 Informative message, check

Copyright © International Union of Crystallography
IUCr Webmaster