Acta Cryst. (2001). E57, m424-m425    [ doi:10.1107/S1600536801014684 ]

Heptacarbonyl-³C,2⁴C-{-dicyclohexyl[1(⁵)-cyclopentadienyl]phosphine-2P}molybdenumrhenium(Mo-Re)

U. Flörke

Online 20 September 2001

Key indicators

• Single-crystal X-ray study
• T = 293 K
• Mean (C-C) = 0.010 Å
• R factor = 0.043
• wR factor = 0.090
• Data-to-parameter ratio = 20.2

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


 Alert Level C:



PLAT_711  Alert C BOND    Unknown or Inconsistent Label ........       X
                           MO1    X

PLAT_712  Alert C ANGLE   Unknown or Inconsistent Label ........       X
                           RE1    MO1    X

PLAT_731  Alert C Bond    Calc    1.420(7), Rep    1.419(3) ....       2.33 s.u-Ratio
                     C31  -C32     1.555   1.555

PLAT_731  Alert C Bond    Calc    1.419(7), Rep    1.419(3) ....       2.33 s.u-Ratio
                     C33  -C34     1.555   1.555

PLAT_731  Alert C Bond    Calc    1.420(7), Rep    1.419(3) ....       2.33 s.u-Ratio
                     C34  -C35     1.555   1.555

PLAT_732  Alert C Angle   Calc   35.13(17), Rep    35.11(8) ....       2.12 s.u-Ratio
                     C32  -MO1  -C31     1.555   1.555   1.555

PLAT_742  Alert C Angle   Calc    108.1(4), Rep      108.00 ....    Missing s.u.
                     C32  -C31  -C35     1.555   1.555   1.555

PLAT_742  Alert C Angle   Calc    107.9(4), Rep      108.00 ....    Missing s.u.
                     C33  -C32  -C31     1.555   1.555   1.555

PLAT_742  Alert C Angle   Calc    108.1(4), Rep      108.00 ....    Missing s.u.
                     C34  -C33  -C32     1.555   1.555   1.555

PLAT_742  Alert C Angle   Calc    108.0(4), Rep      108.00 ....    Missing s.u.
                     C33  -C34  -C35     1.555   1.555   1.555

PLAT_742  Alert C Angle   Calc    107.9(4), Rep      108.00 ....    Missing s.u.
                     C34  -C35  -C31     1.555   1.555   1.555

General Notes



ABSTM_02  When printed, the submitted absorption T values will be replaced      
          by the scaled T values. Since the ratio of scaled T's is              
          identical to the ratio of reported T values, the scaling does         
          not imply a change to the absorption corrections used in the          
          study.                                                                
          Ratio of Tmax expected/reported      0.597                            
          Tmax scaled      0.594 Tmin scaled      0.180                         


 0 Alert Level A = Potentially serious problem

 0 Alert Level B = Potential problem

 11 Alert Level C = Please check

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