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Information card for entry 4324528
Preview
Coordinates | 4324528.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C9 H18 N2 O S2 V |
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Calculated formula | C9 H18 N2 O S2 V |
SMILES | [V]123(SCC[N]42CCC[N]3(CCS1)CC4)=O |
Title of publication | Tetradentate N2S2 Vanadyl(IV) Coordination Complexes: Synthesis, Characterization, and Reactivity Studies |
Authors of publication | Roxanne M. Jenkins; Tiffany A. Pinder; Michelle L. Hatley; Joseph H. Reibenspies; Marcetta Y. Darensbourg |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 1849 - 1855 |
a | 7.2514 ± 0.0018 Å |
b | 9.816 ± 0.002 Å |
c | 16.378 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1165.8 ± 0.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0476 |
Residual factor for significantly intense reflections | 0.0363 |
Weighted residual factors for significantly intense reflections | 0.0582 |
Weighted residual factors for all reflections included in the refinement | 0.0619 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4324528.html
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