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Information card for entry 1505825
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Coordinates | 1505825.cif |
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Original paper (by DOI) | HTML |
Common name | cyclopentylphosphorinane |
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Formula | C14 H28 B F4 P |
Calculated formula | C14 H28 B F4 P |
Title of publication | Phosphorinanes as ligands for palladium-catalyzed cross-coupling chemistry. |
Authors of publication | Brenstrum, Tim; Clattenburg, Julie; Britten, James; Zavorine, Serguei; Dyck, Jeff; Robertson, Alan J.; McNulty, James; Capretta, Alfredo |
Journal of publication | Organic letters |
Year of publication | 2006 |
Journal volume | 8 |
Journal issue | 1 |
Pages of publication | 103 - 105 |
a | 7.9843 ± 0.0001 Å |
b | 13.9102 ± 0.0002 Å |
c | 15.4291 ± 0.0002 Å |
α | 90° |
β | 91.059 ± 0.001° |
γ | 90° |
Cell volume | 1713.31 ± 0.04 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0591 |
Residual factor for significantly intense reflections | 0.0571 |
Weighted residual factors for significantly intense reflections | 0.1632 |
Weighted residual factors for all reflections included in the refinement | 0.1679 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1505825.cif |
120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1505825.cif |
47770 | 2012-03-26 | ../uploads/cif-deposit/cod/cif Adding structures of 1505825 via cif-deposit CGI script. |
1505825.cif |
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Users of the data should acknowledge the original authors of the
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