Acta Cryst. (2002). E58, m557-m558  [ doi:10.1107/S1600536802016343 ]

[RuCl{2,6-bis(3,4-dihydro-2H-pyrrol-5-yl)pyridine}(PPh₃)₂]BF₄ dichloromethane solvate

A. Cabort, B. Therrien, K. Bernauer and G. Süss-Fink

Online 20 September 2002

Key indicators

• Single-crystal X-ray study
• T = 153 K
• Mean (C-C) = 0.004 Å
• Disorder in solvent or counterion
• R factor = 0.031
• wR factor = 0.076
• Data-to-parameter ratio = 13.8

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


 Alert Level C:



REFLT_03                                                                        
         From the CIF: _diffrn_reflns_theta_max           25.86                 
         From the CIF: _reflns_number_total               8322                  
         TEST2: Reflns within _diffrn_reflns_theta_max                          
         Count of symmetry unique reflns         8940                           
         Completeness (_total/calc)             93.09%                          
          Alert C: < 95% complete                                               

PLAT_302  Alert C Anion/Solvent Disorder .......................      27.00 Perc.

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    135
                   C9  -N2  -RU  -CL1  -174.80  0.50   1.555   1.555   1.555   1.555

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    136
                   C5  -N2  -RU  -CL1     4.70  0.70   1.555   1.555   1.555   1.555

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    166
                   C44 -P2  -RU  -P1    105.50  0.20   1.555   1.555   1.555   1.555

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    167
                   C38 -P2  -RU  -P1   -131.70  0.20   1.555   1.555   1.555   1.555

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    168
                   C32 -P2  -RU  -P1    -10.70  0.30   1.555   1.555   1.555   1.555

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    181
                   C14 -P1  -RU  -P2   -106.40  0.20   1.555   1.555   1.555   1.555

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    182
                   C20 -P1  -RU  -P2     10.30  0.30   1.555   1.555   1.555   1.555

PLAT_710  Alert C Delete 1-2-3 or 2-3-4 (CIF) Linear Torsion Angle #    183
                   C26 -P1  -RU  -P2    133.10  0.20   1.555   1.555   1.555   1.555


 0 Alert Level A = Potentially serious problem

 0 Alert Level B = Potential problem

 10 Alert Level C = Please check

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