Acta Cryst. (2010). E66, o1995  [ doi:10.1107/S1600536810026814 ]

(E)-1-(4-Bromophenyl)-3-(2-methoxyphenyl)prop-2-en-1-one

J. P. Jasinski, A. E. Pek, B. Narayana, P. K. Kamath and H. S. Yathirajan

Online 14 July 2010

Key indicators

• Single-crystal X-ray study
• T = 100 K
• Mean (C-C) = 0.002 Å
• R factor = 0.024
• wR factor = 0.070
• Data-to-parameter ratio = 23.8

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density ....       3.07      
PLAT912_ALERT_4_C Missing # of FCF Reflections Above STh/L=  0.600        217      

Alert level G
PLAT128_ALERT_4_G Alternate Setting of Space-group P21/c   .......      P21/n      

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

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

Copyright © International Union of Crystallography
IUCr Webmaster