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Information card for entry 7006012
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Coordinates | 7006012.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Triethylammonium Bisd-((diphenylphosphine(benzo-(1,3)-dioxa-4- methyl))-2-borate |
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Chemical name | Triethylammonium Bisd-[(diphenylphosphine{benzo-(1,3)-dioxa-4- methyl}]-2-borate |
Formula | C48 H56 B N O6 P2 |
Calculated formula | C48 H56 B N O6 P2 |
SMILES | [B]12(Oc3c(O1)cccc3CP(c1ccccc1)c1ccccc1)Oc1c(O2)cccc1CP(c1ccccc1)c1ccccc1.[NH+](CC)(CC)CC.COCCOC |
Title of publication | Boron templated catechol phosphines as bidentate ligands in silver complexes. |
Authors of publication | Chikkali, Samir H.; Gudat, Dietrich; Lissner, Falk; Nieger, Martin; Schleid, Thomas |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 35 |
Pages of publication | 3906 - 3913 |
a | 16.3386 ± 0.0002 Å |
b | 16.35 ± 0.0002 Å |
c | 16.7372 ± 0.0002 Å |
α | 84.929 ± 0.001° |
β | 88.028 ± 0.001° |
γ | 89.833 ± 0.001° |
Cell volume | 4450.97 ± 0.09 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1036 |
Residual factor for significantly intense reflections | 0.0733 |
Weighted residual factors for significantly intense reflections | 0.2187 |
Weighted residual factors for all reflections included in the refinement | 0.2398 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
Diffraction radiation wavelength | 0.71073 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/7006012.html
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Users of the data should acknowledge the original authors of the
structural data.