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Information card for entry 4066938
Preview
Coordinates | 4066938.cif |
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Original paper (by DOI) | HTML |
Formula | C20 H26 Cl N2 Rh |
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Calculated formula | C20 H26 Cl N2 Rh |
SMILES | [Rh]123(Cl)(=C4N(N=Cc5ccccc45)C(C)(C)C)[CH]4=[CH]1CC[CH]2=[CH]3CC4 |
Title of publication | Phthalazin-2-ylidenes As Cyclic Amino Aryl Carbene Ligands in Rhodium(I) and Iridium(I) Complexes |
Authors of publication | Magriz, Antonio; Gómez-Bujedo, Silvia; Álvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M. |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 22 |
Pages of publication | 5941 |
a | 8.4515 ± 0.0005 Å |
b | 14.4911 ± 0.0009 Å |
c | 14.7224 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1803.07 ± 0.19 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0272 |
Residual factor for significantly intense reflections | 0.0213 |
Weighted residual factors for significantly intense reflections | 0.0473 |
Weighted residual factors for all reflections included in the refinement | 0.0498 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178561 (current) | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/69. |
4066938.cif |
91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4066938.cif |
34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4066938.cif |
34028 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4066936, 4066937, 4066938, 4066939, 4066940 via cif-deposit CGI script. |
4066938.cif |
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Users of the data should acknowledge the original authors of the
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