Acta Cryst. (2004). E60, o1367-o1369  [ doi:10.1107/S1600536804017222 ]

3,7-Bis(dimethylamino)phenothiazin-5-ium nitrate dihydrate

S. J. Kavitha, M. M. Raj, K. Panchanatheswaran and D. E. Lynch

Online 24 July 2004

Key indicators

• Single-crystal X-ray study
• T = 120 K
• Mean (C-C) = 0.005 Å
• R factor = 0.068
• wR factor = 0.206
• Data-to-parameter ratio = 16.0

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT244_ALERT_4_C Low  Solvent U(eq) as Compared to Neighbors  for         N1     
PLAT340_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ...          5       
PLAT432_ALERT_2_C Short Inter X...Y Contact  O3     ..  C32     ..       2.96 Ang.  

   0 ALERT level A = In general: serious problem
   0 ALERT level B = Potentially serious problem
   4 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
   1 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

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