(IUCr) Crystallography Journals Online checkcif report

[Contents scheme]

Acta Cryst. (2005). E61, m2395-m2396 [ doi:10.1107/S1600536805033817 ]

Cobalt(II) formate hydroxide

Y.-L. Fu, J.-L. Ren, Z.-W. Xu and S. W. Ng

Online 27 October 2005

Key indicators

Single-crystal X-ray study
T = 295 K
Mean (O-C) = 0.005 Å
R factor = 0.031
wR factor = 0.077
Data-to-parameter ratio = 12.9

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT062_ALERT_4_C Rescale T(min) & T(max) by .....................       0.96       
PLAT152_ALERT_1_C Supplied and Calc Volume s.u. Inconsistent .....          ?
PLAT164_ALERT_4_C Nr. of Refined C-H H-Atoms in Heavy-At Struct...          1       
PLAT480_ALERT_4_C Long H...A H-Bond Reported H3     ..  O1      ..       2.76 Ang.  
PLAT482_ALERT_4_C Small D-H..A Angle Rep for O3     ..  O1      ..      91.00 Deg.  
PLAT731_ALERT_1_C Bond    Calc     0.84(4), Rep   0.850(10) ......       4.00 su-Rat
              O3   -H3      1.555   1.555                                       
PLAT735_ALERT_1_C D-H     Calc     0.84(4), Rep   0.850(10) ......       4.00 su-Rat
              O3   -H3      1.555   1.555                                       
PLAT764_ALERT_4_C Overcomplete CIF Bond List Detected (Rep/Expd) .       1.25 Ratio 

   0 ALERT level A = In general: serious problem
   0 ALERT level B = Potentially serious problem
   8 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
   0 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
   5 ALERT type 4 Improvement, methodology, query or suggestion