(IUCr) Crystallography Journals Online checkcif report

[Contents scheme]

Acta Cryst. (2004). E60, m1719-m1721 [ doi:10.1107/S1600536804026558 ]

(2,2'-Bipyridine)dichlorogold(III) nitrate

J. K. Bjernemose, P. R. Raithby and H. Toftlund

Key indicators

Single-crystal X-ray study
T = 150 K
Mean (C-C) = 0.008 Å
R factor = 0.026
wR factor = 0.053
Data-to-parameter ratio = 14.2

checkCIF/PLATON results

No syntax errors found




Alert level B
ABSTM02_ALERT_3_B  The ratio of expected to reported Tmax/Tmin(RR) is > 1.50
            Tmin and Tmax reported:      0.461     0.544
            Tmin and Tmax expected:      0.247     0.546
            RR =      1.873
            Please check that your absorption correction is appropriate.
PLAT060_ALERT_3_B Ratio Tmax/Tmin (Exp-to-Rep) (too) Large .......       1.90       

Alert level C
PLAT244_ALERT_4_C Low  Solvent U(eq) as Compared to Neighbors  for         N2     
PLAT480_ALERT_4_C Long H...A H-Bond Reported H5     ..  O1      ..       2.65 Ang.  
PLAT480_ALERT_4_C Long H...A H-Bond Reported H5     ..  O2      ..       2.71 Ang.  

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

   0 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
   2 ALERT type 3 Indicator that the structure quality may be low
   3 ALERT type 4 Improvement, methodology, query or suggestion