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Information card for entry 7039014
Preview
Coordinates | 7039014.cif |
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Original paper (by DOI) | HTML |
Common name | K5PDIMoH2 |
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Formula | C39 H41 Mo N3 P2 |
Calculated formula | C39 H41 Mo N3 P2 |
SMILES | [Mo]1234[P](CCC[N]2=C(C)c2[n]3c(ccc2)C(=[N]4CCC[P]1(c1ccccc1)c1ccccc1)C)(c1ccccc1)c1ccccc1 |
Title of publication | Isolation of a bis(imino)pyridine molybdenum(i) iodide complex through controlled reduction and interconversion of its reaction products. |
Authors of publication | Pal, Raja; Cherry, Brian R.; Flores, Marco; Groy, Thomas L.; Trovitch, Ryan J. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 24 |
Pages of publication | 10024 - 10033 |
a | 8.0248 ± 0.0003 Å |
b | 10.408 ± 0.0005 Å |
c | 19.9821 ± 0.0009 Å |
α | 88.4317 ± 0.0007° |
β | 89.3949 ± 0.0007° |
γ | 89.6286 ± 0.0007° |
Cell volume | 1668.2 ± 0.13 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0396 |
Residual factor for significantly intense reflections | 0.0332 |
Weighted residual factors for significantly intense reflections | 0.08 |
Weighted residual factors for all reflections included in the refinement | 0.0829 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
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/7039014.html
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Users of the data should acknowledge the original authors of the
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