(IUCr) Crystallography Journals Online checkcif report

[Contents scheme]

Acta Cryst. (2005). E61, o2270-o2271 [ doi:10.1107/S1600536805019446 ]

2-(4,6-Dimethoxypyrimidin-2-yloxy)-6-fluoro-N-(3-methylpyridyl)benzylamine

D.-L. Shen, Q.-S. Gong, C.-X. Tan, Z.-M. Jin, J.-Q. Weng and N.-B. Sun

Online 24 June 2005

Key indicators

Single-crystal X-ray study
T = 295 K
Mean (C-C) = 0.003 Å
R factor = 0.050
wR factor = 0.173
Data-to-parameter ratio = 16.0

checkCIF/PLATON results

No syntax errors found




Alert level B
PLAT411_ALERT_2_B Short Inter H...H Contact  H7A    ..  H7A     ..       2.01 Ang.  
PLAT414_ALERT_2_B Short Intra D-H..H-X       HN1    ..  H13A    ..       1.81 Ang.  

Alert level C
PLAT029_ALERT_3_C _diffrn_measured_fraction_theta_full Low .......       0.97       
PLAT380_ALERT_4_C Check Incorrectly? Oriented X(sp2)-Methyl Moiety        C13     
PLAT720_ALERT_4_C Number of Unusual/Non-Standard Label(s) ........          1       

   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
   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
   2 ALERT type 4 Improvement, methodology, query or suggestion