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Information card for entry 4327454
Preview
Coordinates | 4327454.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H57 Mo6 N Na2 O34 |
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Calculated formula | C42 Mo6 N Na2 O34 |
SMILES | C1C[O]2c3ccccc3[O]3CC[O]4CC[O]5c6ccccc6[O]6CC[O]1[Na]23456[OH2].C(#N)C.O.O=[Mo]1234O[Mo]567(=O)[O]89%101[Mo]1%11(=O)(O[Mo]9(=O)(O3)(O7)O[Mo]%10(=O)(O%11)(O4)O[Mo]8(=O)(O2)(O1)O6)O5.C1C[O]2c3ccccc3[O]3CC[O]4CC[O]5c6ccccc6[O]6CC[O]1[Na]23456[OH2].CC#N |
Title of publication | New High-Dimensional Networks Based on Polyoxometalate and Crown Ether Building Blocks |
Authors of publication | Yangguang Li; Na Hao; Enbo Wang; Mei Yuan; Changwen Hu; Ninghai Hu; Hengqing Jia |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 2729 - 2735 |
a | 16.9701 ± 0.0006 Å |
b | 16.9701 ± 0.0006 Å |
c | 14.2676 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4108.8 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 127 |
Hermann-Mauguin space group symbol | P 4/m b m |
Hall space group symbol | -P 4 2ab |
Residual factor for all reflections | 0.0819 |
Residual factor for significantly intense reflections | 0.0667 |
Weighted residual factors for significantly intense reflections | 0.1997 |
Weighted residual factors for all reflections included in the refinement | 0.2066 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4327454.html
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Users of the data should acknowledge the original authors of the
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