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Information card for entry 4071708
Preview
Coordinates | 4071708.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H56 Fe2 Mo N4 P4 |
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Calculated formula | C36 H56 Fe2 Mo N4 P4 |
SMILES | [Mo]12([P]([c]34[Fe]56789%10%11([cH]3[cH]5[cH]6[cH]47)[c]3([P]1(CC)CC)[cH]8[cH]9[cH]%10[cH]%113)(CC)CC)([P]([c]13[Fe]456789%10([cH]1[cH]4[cH]5[cH]36)[c]1([cH]%10[cH]9[cH]8[cH]71)[P]2(CC)CC)(CC)CC)([N]#N)[N]#N |
Title of publication | Synthesis and Reactivity of Tungsten− and Molybdenum−Dinitrogen Complexes Bearing Ferrocenyldiphosphines toward Protonolysis |
Authors of publication | Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki; Wakiji, Issei; Hidai, Masanobu |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 15 |
Pages of publication | 3947 |
a | 10.3341 ± 0.0003 Å |
b | 12.9756 ± 0.0004 Å |
c | 16.0505 ± 0.0004 Å |
α | 68.4688 ± 0.0018° |
β | 75.0902 ± 0.0017° |
γ | 75.3883 ± 0.0008° |
Cell volume | 1904.58 ± 0.1 Å3 |
Cell temperature | 173.1 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for significantly intense reflections | 0.0258 |
Weighted residual factors for all reflections included in the refinement | 0.0898 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
Diffraction radiation wavelength | 0.71069 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/4071708.html
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Users of the data should acknowledge the original authors of the
structural data.