Acta Cryst. (2003). E59, m1089-m1090  [ doi:10.1107/S1600536803024747 ]

Hexakis(1H-imidazole-N³)cobalt(II) dichloride tetrahydrate

H.-L. Zhu, S. Yang, X.-Y. Qiu, Z.-D. Xiong, Z.-L. You and D.-Q. Wang

Online 8 November 2003

Key indicators

• Single-crystal X-ray study
• T = 298 K
• R factor = 0.044
• wR factor = 0.131
• Data-to-parameter ratio = 14.8

checkCIF/PLATON results

No syntax errors found




Alert level B
PLAT029_ALERT_3_B _diffrn_measured_fraction_theta_full Low .......       0.98       
PLAT415_ALERT_2_B Short Inter D-H..H-X       H2C    ..  H4A      =       1.98 Ang.  
PLAT417_ALERT_2_B Short Inter D-H..H-D       H1C    ..  H1C      =       1.86 Ang.  

Alert level C
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT152_ALERT_1_C Supplied and Calc Volume s.u. Inconsistent .....          ?
PLAT417_ALERT_2_C Short Inter D-H..H-D       H1B    ..  H2C      =       2.14 Ang.  
PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #          5     
            N1  -CO1 -N1  -C1    159.00100.00   2.555   1.555   1.555   1.555   
PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #         10     
            N1  -CO1 -N1  -C3    -16.00100.00   2.555   1.555   1.555   1.555   
PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #         11     
            N3  -CO1 -N3  -C4     45.00100.00   2.555   1.555   1.555   1.555   
PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #         16     
            N3  -CO1 -N3  -C6   -137.00100.00   2.555   1.555   1.555   1.555   
PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #         23     
            N5  -CO1 -N5  -C7    143.00 43.00   2.555   1.555   1.555   1.555   
PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... #         28     
            N5  -CO1 -N5  -C9    -40.00 43.00   2.555   1.555   1.555   1.555   

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

   2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   3 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
   6 ALERT type 4 Improvement, methodology, query or suggestion

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