Acta Cryst. (2004). E60, m501-m503  [ doi:10.1107/S1600536804007263 ]

Aquachlorobis(1,10-phenanthroline)cobalt(II) chloride dimethylformamide solvate

J.-W. Liu, S. Gao, L.-H. Huo and S. W. Ng

Online 31 March 2004

Key indicators

• Single-crystal X-ray study
• T = 293 K
• Mean (C-C) = 0.004 Å
• R factor = 0.048
• wR factor = 0.133
• Data-to-parameter ratio = 17.6

checkCIF/PLATON results

No syntax errors found



Alert level A
PLAT241_ALERT_2_A Check High   U(eq) as Compared to Neighbors ....        C27     

PLAT241_ALERT_2_A Check High   U(eq) as Compared to Neighbors ....       C27'     

PLAT242_ALERT_2_A Check Low    U(eq) as Compared to Neighbors ....         N5     

PLAT242_ALERT_2_A Check Low    U(eq) as Compared to Neighbors ....        N5'     

Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors ....        C25     

PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors ....       C25'     

PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors ....        C26     

PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors ....       C26'     

PLAT301_ALERT_3_C Main Residue  Disorder .........................      12.00 Perc. 
PLAT313_ALERT_2_C Oxygen with three covalent bonds (rare) ........         O1     
PLAT313_ALERT_2_C Oxygen with three covalent bonds (rare) ........        O1'     
PLAT720_ALERT_4_C Number of Unusual/Non-Standard Label(s) ........          2       
PLAT731_ALERT_1_C Bond    Calc     0.84(3), Rep   0.840(10) ......       3.00 su-Rat
              O1W  -H1W1    1.555   1.555                                       
PLAT735_ALERT_1_C D-H     Calc     0.84(3), Rep   0.840(10) ......       3.00 su-Rat
              O1W  -H1#     1.555   1.555                                       
PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd.  #          2       
              C6 H14 N2 O2                                                      

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

   3 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
  10 ALERT type 2 Indicator that the structure model may be wrong or deficient
   1 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