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Information card for entry 4110062
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Coordinates | 4110062.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | cmpd_7a |
---|---|
Formula | C42 H74 Hf2 N8 Si |
Calculated formula | C42 H74 Hf2 N8 Si |
SMILES | [Hf]1234567([H][Hf]89%10%11%12(N1N2[SiH2]c1ccccc1)([N](=C(N8C(C)C)N(C)C)C(C)C)[cH]1[c]%10([c]%11([c]9([c]%121C)C)C)C)(N(C(=[N]3C(C)C)N(C)C)C(C)C)[cH]1[c]4([c]7([c]6([c]51C)C)C)C |
Title of publication | Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic "Side-on-Bridged" Dinitrogen Complexes for Zirconium and Hafnium |
Authors of publication | Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2007 |
Journal volume | 129 |
Pages of publication | 12690 - 12692 |
a | 40.804 ± 0.002 Å |
b | 45.984 ± 0.002 Å |
c | 9.8364 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 18456.3 ± 1.5 Å3 |
Cell temperature | 220 ± 2 K |
Ambient diffraction temperature | 220 ± 2 K |
Number of distinct elements | 5 |
Space group number | 43 |
Hermann-Mauguin space group symbol | F d d 2 |
Hall space group symbol | F 2 -2d |
Residual factor for all reflections | 0.042 |
Residual factor for significantly intense reflections | 0.0367 |
Weighted residual factors for significantly intense reflections | 0.0712 |
Weighted residual factors for all reflections included in the refinement | 0.0728 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
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/4110062.html
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Users of the data should acknowledge the original authors of the
structural data.