Acta Cryst. (2010). E66, m420  [ doi:10.1107/S1600536810009736 ]

[(Z)-O-Isopropyl N-(4-chlorophenyl)thiocarbamato-S](tricyclohexylphosphine-P)gold(I)

P. P. Tadbuppa and E. R. T. Tiekink

Online 20 March 2010

Key indicators

• Single-crystal X-ray study
• T = 223 K
• Mean (C-C) = 0.008 Å
• R factor = 0.039
• wR factor = 0.087
• Data-to-parameter ratio = 22.4

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density ....       3.29      
PLAT241_ALERT_2_C Check High      Ueq as Compared to Neighbors for         S1     
PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) .....          1      
PLAT912_ALERT_4_C Missing # of FCF Reflections Above STh/L=  0.600          2      

Alert level G
PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #          1     
            P1  -AU  -S1  -C1   -159.30  0.40   1.555   1.555   1.555   1.555  
PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #          2     
            S1  -AU  -P1  -C23    29.20  0.50   1.555   1.555   1.555   1.555  
PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #          3     
            S1  -AU  -P1  -C11   152.80  0.40   1.555   1.555   1.555   1.555  
PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #          4     
            S1  -AU  -P1  -C17   -87.80  0.50   1.555   1.555   1.555   1.555  

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

   0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   2 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
   5 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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