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Information card for entry 2006674
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Coordinates | 2006674.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | Bis[(η^5^-cyclopentadienyl)(μ-selenido)(μ-ethylselenolato)]- dimolybdenum(IV)(Mo=Mo) |
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Formula | C14 H20 Mo2 Se4 |
Calculated formula | C14 H20 Mo2 Se4 |
SMILES | [cH]12[cH]3[cH]4[cH]5[cH]1[Mo]16782345[Se][Mo]23456([Se]1CC)([cH]1[cH]5[cH]4[cH]3[cH]21)([Se]7)[Se]8CC |
Title of publication | Organometallic Selenolates. VII. (Benzylselenolato-<i>Se</i>)tricarbonyl(η^5^-cyclopentadienyl)molybdenum(II) and Bis[1,2(η^5^)-cyclopentadienyl]-di-μ-ethylselenolato-di-μ-selenido-dimolybdenum(IV)(<i>Mo</i>—<i>Mo</i>) |
Authors of publication | Thöne, Carsten; Jones, Peter G.; Laube, Jörg |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1997 |
Journal volume | 53 |
Journal issue | 11 |
Pages of publication | 1539 - 1542 |
a | 8.4036 ± 0.0015 Å |
b | 15.376 ± 0.003 Å |
c | 6.9712 ± 0.0012 Å |
α | 90° |
β | 99.092 ± 0.008° |
γ | 90° |
Cell volume | 889.5 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0207 |
Residual factor for significantly intense reflections | 0.0192 |
Weighted residual factors for all reflections | 0.047 |
Weighted residual factors for significantly intense reflections | 0.0461 |
Goodness-of-fit parameter for all reflections | 1.093 |
Goodness-of-fit parameter for significantly intense reflections | 1.102 |
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/2006674.html
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