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Information card for entry 7709154
Preview
Coordinates | 7709154.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H43 Cl I Mo N O P2 |
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Calculated formula | C23 H43 Cl I Mo N O P2 |
SMILES | I[Mo]12(Cl)([P](Cc3[n]2c(ccc3)C[P]1(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)=O |
Title of publication | Reactivity of molybdenum-nitride complex bearing pyridine-based PNP-type pincer ligand toward carbon-centered electrophiles. |
Authors of publication | Itabashi, Takayuki; Arashiba, Kazuya; Kuriyama, Shogo; Nishibayashi, Yoshiaki |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2022 |
Journal volume | 51 |
Journal issue | 5 |
Pages of publication | 1946 - 1954 |
a | 13.0791 ± 0.0005 Å |
b | 15.0104 ± 0.0004 Å |
c | 15.3134 ± 0.0005 Å |
α | 90° |
β | 106.185 ± 0.004° |
γ | 90° |
Cell volume | 2887.21 ± 0.17 Å3 |
Cell temperature | 93 K |
Ambient diffraction temperature | 93 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0682 |
Residual factor for significantly intense reflections | 0.0516 |
Weighted residual factors for significantly intense reflections | 0.131 |
Weighted residual factors for all reflections included in the refinement | 0.1412 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
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/7709154.html
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