Acta Cryst. (2006). E62, m3029-m3030  [ doi:10.1107/S1600536806043133 ]

Hexaaquacobalt(II) bis(4-nitrophenoxyacetate) pentahydrate

J.-S. Gao, B.-Y. Li, G.-F. Hou, Y.-M. Zhang and P.-F. Yan

Online 25 October 2006

Key indicators

• Single-crystal X-ray study
• T = 295 K
• Mean (C-C) = 0.003 Å
• R factor = 0.031
• wR factor = 0.085
• Data-to-parameter ratio = 17.2

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Co1    -   O11     ..       7.19 su   
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Co1    -   O12     ..       7.06 su   
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Co1    -   O15     ..       5.73 su   
PLAT242_ALERT_2_C Check Low       Ueq as Compared to Neighbors for         N2     
PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor ....       2.16      
PLAT480_ALERT_4_C Long H...A H-Bond Reported H30    ..  O7      ..       2.61 Ang. 

   0 ALERT level A = In general: serious problem
   0 ALERT level B = Potentially serious problem
   7 ALERT level C = Check and explain
   0 ALERT level G = General alerts; check

   1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   5 ALERT type 2 Indicator that the structure model may be wrong or deficient
   0 ALERT type 3 Indicator that the structure quality may be low
   1 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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