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Information card for entry 4087899
Preview
Coordinates | 4087899.cif |
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Original paper (by DOI) | HTML |
Formula | C58 H84 Mn2 N4 |
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Calculated formula | C58 H84 Mn2 N4 |
SMILES | C1(N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)=[Mn]12(C)[CH3][Mn]2(=C2N(C=CN2c2c(cccc2C(C)C)C(C)C)c2c(cccc2C(C)C)C(C)C)([CH3]1)C |
Title of publication | Synthesis and Reactivity of Manganese(II) Complexes Containing N-Heterocyclic Carbene Ligands |
Authors of publication | Al-Afyouni, Malik H.; Krishnan, V. Mahesh; Arman, Hadi D.; Tonzetich, Zachary J. |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 20 |
Pages of publication | 5088 |
a | 12.418 ± 0.007 Å |
b | 14.287 ± 0.008 Å |
c | 16.117 ± 0.009 Å |
α | 90° |
β | 95.813 ± 0.009° |
γ | 90° |
Cell volume | 2845 ± 3 Å3 |
Cell temperature | 98 ± 2 K |
Ambient diffraction temperature | 98 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0907 |
Residual factor for significantly intense reflections | 0.0727 |
Weighted residual factors for significantly intense reflections | 0.1467 |
Weighted residual factors for all reflections included in the refinement | 0.1582 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
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/4087899.html
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