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Information card for entry 4065801
Preview
Coordinates | 4065801.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H52 N2 O8 Se5 W |
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Calculated formula | C28 H52 N2 O8 Se5 W |
SMILES | [W]12(=[Se])([Se]C(=C([Se]1)C(=O)OC)C(=O)OC)[Se]C(=C([Se]2)C(=O)OC)C(=O)OC.[N+](CC)(CC)(CC)CC.[N+](CC)(CC)(CC)CC |
Title of publication | Addition of Dimethyl Acetylenedicarboxylate to the [WSe4]2−Anion |
Authors of publication | Chiu, Wai-Hang; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 11 |
Pages of publication | 2631 |
a | 12.903 ± 0.003 Å |
b | 18.625 ± 0.005 Å |
c | 31.683 ± 0.008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7614 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.062 |
Residual factor for significantly intense reflections | 0.0585 |
Weighted residual factors for significantly intense reflections | 0.0816 |
Weighted residual factors for all reflections included in the refinement | 0.0918 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.972 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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