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Information card for entry 7000182
Preview
Coordinates | 7000182.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H21 N2 O P |
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Calculated formula | C26 H21 N2 O P |
SMILES | P(=O)(CNN=C1c2ccccc2c2ccccc12)(c1ccccc1)c1ccccc1 |
Title of publication | A novel fluorene-containing κ4-P2N2-tetradentate platinum(II) complex |
Authors of publication | Elsegood, Mark R. J.; Lake, Andrew J.; Smith, Martin B. |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 1 |
Pages of publication | 30 - 32 |
a | 12.6349 ± 0.0007 Å |
b | 13.7094 ± 0.0008 Å |
c | 13.7679 ± 0.0008 Å |
α | 71.744 ± 0.002° |
β | 84.887 ± 0.002° |
γ | 71.011 ± 0.002° |
Cell volume | 2141.3 ± 0.2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0712 |
Residual factor for significantly intense reflections | 0.0446 |
Weighted residual factors for significantly intense reflections | 0.1028 |
Weighted residual factors for all reflections included in the refinement | 0.1181 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179679 (current) | 2016-03-24 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/01. |
7000182.cif |
120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7000182.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7000182.cif |
1143 | 2010-05-03 | cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition. |
7000182.cif |
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Users of the data should acknowledge the original authors of the
structural data.