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Information card for entry 4070697
Preview
Coordinates | 4070697.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H38 B2 F8 Mo N7 |
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Calculated formula | C25 H38 B2 F8 Mo N7 |
SMILES | [Mo]1234567([N](CC[N]1=c1n(c(c(n1C)C)C)C)=c1n(c(c(n1C)C)C)C)([N]#CC)[CH]1=[CH]7[CH]6=[CH]5[CH]4=[CH]3C21.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-] |
Title of publication | Synthesis and Reactivity of 16-Electron Cycloheptatrienyl-Molybdenum(0) Complexes with Bis(imidazolin-2-imine) Ligands |
Authors of publication | Petrovic, Dejan; Hrib, Cristian G.; Randoll, Sören; Jones, Peter G.; Tamm, Matthias |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 4 |
Pages of publication | 778 |
a | 20.015 ± 0.002 Å |
b | 14.9142 ± 0.0014 Å |
c | 20.075 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5992.5 ± 1 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 2 K |
Number of distinct elements | 6 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0684 |
Residual factor for significantly intense reflections | 0.0366 |
Weighted residual factors for significantly intense reflections | 0.0806 |
Weighted residual factors for all reflections included in the refinement | 0.099 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4070697.html
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