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Information card for entry 7115528
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7115528.cif |
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Original paper (by DOI) | HTML |
Formula | C41 H40 Ga Mo N2 O5 |
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Calculated formula | C41 H40 Ga Mo N2 O5 |
SMILES | [O]#C[Mo]([Ga]1[N](=C2C(c3cccc4cccc2c34)=[N]1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Adaptive behavior of a redox-active gallium carbenoid in complexes with molybdenum |
Authors of publication | Igor L. Fedushkin; Vladimir G. Sokolov; Alexander V. Piskunov; Valentine M. Makarov; Eugeny V. Baranov; Gleb A. Abakumov |
Journal of publication | Chem.Commun. |
Year of publication | 2014 |
Journal volume | 50 |
Pages of publication | 10108 |
a | 17.1431 ± 0.0012 Å |
b | 15.7892 ± 0.0011 Å |
c | 14.4285 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3905.4 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0298 |
Residual factor for significantly intense reflections | 0.0242 |
Weighted residual factors for significantly intense reflections | 0.0646 |
Weighted residual factors for all reflections included in the refinement | 0.0672 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
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/7115528.html
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Users of the data should acknowledge the original authors of the
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