Acta Cryst. (2004). E60, o142-o144  [ doi:10.1107/S1600536803029222 ]

1-[N-(p-Hydroxyphenyl)aminomethylidene]naphthalen-2(1H)-one propan-1-ol hemisolvate

M. Odabasoglu, Ç. Albayrak and O. Büyükgüngör

Online 24 December 2003

Key indicators

• Single-crystal X-ray study
• T = 293 K
• Mean (C-C) = 0.003 Å
• R factor = 0.047
• wR factor = 0.136
• Data-to-parameter ratio = 17.1

checkCIF/PLATON results

No syntax errors found




Alert level B
PLAT230_ALERT_2_B Hirshfeld Test Diff for    C21    -   C22      =       8.22 su    

Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C1     -   C2       =       6.05 su    
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C4     -   C5       =       5.16 su    
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C18    -   C19      =       6.84 su    
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C23    -   C24      =       5.27 su    
PLAT360_ALERT_2_C Short  C(sp3)-C(sp3) Bond  C35    -   C36      =       1.38 Ang.  
PLAT360_ALERT_2_C Short  C(sp3)-C(sp3) Bond  C36    -   C37      =       1.38 Ang.  
PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd.  #          3       
              C3 H8 O                                                           

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

   1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   7 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
   1 ALERT type 4 Improvement, methodology, query or suggestion

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