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Information card for entry 7702873
Preview
Coordinates | 7702873.cif |
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Original paper (by DOI) | HTML |
Common name | Molybdenum(VI) oxide 2:1 complex with 1,2-bis(1,2,4-triazol-4- yl)ethane |
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Chemical name | Molybdenum(VI) oxide 2:1 complex with 1,2-bis(1,2,4-triazol-4-yl)ethane |
Formula | C12 H16 Mo4 N12 O12 |
Calculated formula | C12 H16 Mo4 N12 O12 |
Title of publication | Metal oxide-organic frameworks (MOOFs), a new series of coordination hybrids constructed from molybdenum(VI) oxide and bitopic 1,2,4-triazole linkers. |
Authors of publication | Lysenko, Andrey B.; Senchyk, Ganna A.; Lincke, Jörg; Lässig, Daniel; Fokin, Andrey A.; Butova, Ekaterina D.; Schreiner, Peter R.; Krautscheid, Harald; Domasevitch, Konstantin V. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 17 |
Pages of publication | 4223 - 4231 |
a | 15.2779 ± 0.0016 Å |
b | 12.6491 ± 0.0013 Å |
c | 12.1712 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2352.1 ± 0.4 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0805 |
Residual factor for significantly intense reflections | 0.0543 |
Weighted residual factors for significantly intense reflections | 0.1194 |
Weighted residual factors for all reflections included in the refinement | 0.1369 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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244083 (current) | 2019-11-28 | cif/ Adding structures of 7702873, 7702874, 7702875, 7702876, 7702877, 7702878, 7702879 via cif-deposit CGI script. |
7702873.cif |
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Users of the data should acknowledge the original authors of the
structural data.