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Information card for entry 4344734
Preview
Coordinates | 4344734.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49 H51 B2 F8 Fe N4 P3 |
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Calculated formula | C49 H51 B2 F8 Fe N4 P3 |
SMILES | [Fe]12([P](c3ccccc3)(c3ccccc3)CC(C[P]1(c1ccccc1)c1ccccc1)(C[P]2(c1ccccc1)c1ccccc1)C)([N]#CC)([N]#CC)[N]#CC.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-].C(#N)C |
Title of publication | Controlled Flexible Coordination in Tripodal Iron(II) Phosphane Complexes: Effects on Reactivity. |
Authors of publication | Petuker, Anette; Merz, Klaus; Merten, Christian; Apfel, Ulf-Peter |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 3 |
Pages of publication | 1183 - 1191 |
a | 13.352 ± 0.007 Å |
b | 18.685 ± 0.01 Å |
c | 19.802 ± 0.01 Å |
α | 90° |
β | 90.679 ± 0.008° |
γ | 90° |
Cell volume | 4940 ± 4 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0691 |
Residual factor for significantly intense reflections | 0.0526 |
Weighted residual factors for significantly intense reflections | 0.141 |
Weighted residual factors for all reflections included in the refinement | 0.157 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0432 |
Diffraction radiation wavelength | 0.710747 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4344734.html
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