Acta Cryst. (2004). E60, m1510-m1512  [ doi:10.1107/S1600536804023396 ]

The 1:2/3  adduct of manganese(II) terephthalate with N,N-dimethylformamide

Y.-L. Fu, J.-L. Ren, H.-P. Qiao and S. W. Ng

Online 30 September 2004

Key indicators

• Single-crystal X-ray study
• T = 295 K
• Mean (C-C) = 0.005 Å
• R factor = 0.041
• wR factor = 0.109
• Data-to-parameter ratio = 15.6

checkCIF/PLATON results

No syntax errors found



Alert level A
PLAT220_ALERT_2_A Large Non-Solvent    C     Ueq(max)/Ueq(min) ...       6.89 Ratio 

PLAT222_ALERT_3_A Large Non-Solvent    H     Ueq(max)/Ueq(min) ...       5.07 Ratio 

Alert level B
PLAT241_ALERT_2_B Check High   U(eq) as Compared to Neighbors  for         O6     
PLAT241_ALERT_2_B Check High   U(eq) as Compared to Neighbors  for        C14     
PLAT241_ALERT_2_B Check High   U(eq) as Compared to Neighbors  for       C14'     
PLAT241_ALERT_2_B Check High   U(eq) as Compared to Neighbors  for        C15     
PLAT241_ALERT_2_B Check High   U(eq) as Compared to Neighbors  for       C15'     

Alert level C
PLAT213_ALERT_2_C Atom O6      has ADP max/min Ratio .............       3.10 prolat
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O7     
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        Mn1     
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        Mn2     
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for         N1     
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        N1'     
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        C13     
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for       C13'     
PLAT301_ALERT_3_C Main Residue  Disorder .........................      14.00 Perc. 

   2 ALERT level A = In general: serious problem
   5 ALERT level B = Potentially serious problem
   9 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
  14 ALERT type 2 Indicator that the structure model may be wrong or deficient
   2 ALERT type 3 Indicator that the structure quality may be low
   0 ALERT type 4 Improvement, methodology, query or suggestion

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