Acta Cryst. (2004). E60, m426-m428  [ doi:10.1107/S1600536804005434 ]

Di--chloro-bis{[N,N-bis(3,5-dimethylpyrazol-1-ylmethyl)-1-hydroxyethanamine]copper(II)} dichloride dihydrate

M. El Kodadi, M. Fouad, A. Ramdani, D. Eddike, M. Tillard and C. Belin

Online 20 March 2004

Key indicators

• Single-crystal X-ray study
• T = 293 K
• Mean (C-C) = 0.004 Å
• R factor = 0.038
• wR factor = 0.109
• Data-to-parameter ratio = 19.6

checkCIF/PLATON results

No syntax errors found




Alert level B
PLAT230_ALERT_2_B Hirshfeld Test Diff for    N1     -   C9      ..       7.08 su    

Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT230_ALERT_2_C Hirshfeld Test Diff for    N1     -   C6      ..       5.10 su    
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Cu     -   Cl1     ..       5.23 su    
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Cu     -   O1      ..       5.82 su    
PLAT720_ALERT_4_C Number of Unusual/Non-Standard Label(s) ........          3       
PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd.  #          2       
              H2 O                                                              

   0 ALERT level A = In general: serious problem
   1 ALERT level B = Potentially serious problem
   6 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
   4 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
   2 ALERT type 4 Improvement, methodology, query or suggestion

Copyright © International Union of Crystallography
IUCr Webmaster