Acta Cryst. (2005). E61, m787-m789  [ doi:10.1107/S1600536805009529 ]

Chlorobis(1,10-phenanthroline-²N,N')copper(II) nitrate 4-nitrobenzoic acid monohydrate

T.-G. Xu, J.-G. Liu and D.-J. Xu

Online 31 March 2005

Key indicators

• Single-crystal X-ray study
• T = 295 K
• Mean (C-C) = 0.004 Å
• Disorder in solvent or counterion
• R factor = 0.045
• wR factor = 0.110
• Data-to-parameter ratio = 15.1

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT242_ALERT_2_C Check Low       Ueq as Compared to Neighbors for         N5     
PLAT244_ALERT_4_C Low   'Solvent' Ueq as Compared to Neighbors for         N6     
PLAT302_ALERT_4_C Anion/Solvent Disorder .........................      37.00 Perc. 

   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
   0 ALERT type 3 Indicator that the structure quality may be low
   2 ALERT type 4 Improvement, methodology, query or suggestion

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