Acta Cryst. (2010). E66, m1417-m1418  [ doi:10.1107/S1600536810040791 ]

1-(Diphenylphosphinothioyl)-2-[(4-methylphenyl)methoxymethyl]ferrocene

J.-C. Daran, C. Audin, E. Deydier, E. Manoury and R. Poli

Online 20 October 2010

Key indicators

• Single-crystal X-ray study
• T = 180 K
• Mean (C-C) = 0.004 Å
• R factor = 0.041
• wR factor = 0.108
• Data-to-parameter ratio = 13.9

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L=  0.595        160      

Alert level G
PLAT154_ALERT_1_G The su's on the Cell Angles are Equal  (x 10000)        300 Deg. 
PLAT380_ALERT_4_G Check Incorrectly? Oriented X(sp2)-Methyl Moiety       C417     

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

   1 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
   1 ALERT type 3 Indicator that the structure quality may be low
   1 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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