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Information card for entry 4323522
Preview
Coordinates | 4323522.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H32 N2 O6 W |
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Calculated formula | C18 H32 N2 O6 W |
SMILES | [W]1(OC(=O)[C@@H]([NH2]1)C(C)(C)C)(C#[O])(C#[O])(C#[O])C#[O].[N+](CC)(CC)(CC)CC |
Title of publication | Amino Acid Complexes of Metal Carbonyls: Mechanistic Aspects of the CO-Labilizing Ability of Glycinate Ligands in Zero-Valent Chromium and Tungsten Derivatives |
Authors of publication | Donald J. Darensbourg; Jennifer D. Draper; Joseph H. Reibenspies |
Journal of publication | Inorganic Chemistry |
Year of publication | 1997 |
Journal volume | 36 |
Pages of publication | 3648 - 3656 |
a | 11.976 ± 0.002 Å |
b | 11.745 ± 0.002 Å |
c | 16.646 ± 0.002 Å |
α | 90° |
β | 110.05 ± 0.01° |
γ | 90° |
Cell volume | 2199.5 ± 0.6 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0737 |
Residual factor for significantly intense reflections | 0.0582 |
Weighted residual factors for all reflections | 0.1808 |
Weighted residual factors for significantly intense reflections | 0.1368 |
Goodness-of-fit parameter for all reflections | 1.1 |
Goodness-of-fit parameter for significantly intense reflections | 0.926 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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