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Information card for entry 4070509
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4070509.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H41 B8 N3 Pt |
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Calculated formula | C15 H41 B8 N3 Pt |
SMILES | [Pt]12(C#N)(C#[N]C(C)(C)C)[BH]345[BH]678[BH]9%10%11[CH2]([BH]%127%10[BH]258[H]%12)[BH]25%11[BH]369[BH]142[H]5.[N+](CC)(CC)(CC)CC |
Title of publication | Synthesis and Reactivity of 10-Vertexarachno-Platinacarboranes |
Authors of publication | Carr, Michael J.; McGrath, Thomas D.; Stone, F. Gordon A. |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 9 |
Pages of publication | 2099 |
a | 20.4041 ± 0.0007 Å |
b | 9.719 ± 0.0003 Å |
c | 13.7472 ± 0.0004 Å |
α | 90° |
β | 116.543 ± 0.003° |
γ | 90° |
Cell volume | 2438.83 ± 0.15 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 5 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0253 |
Residual factor for significantly intense reflections | 0.0217 |
Weighted residual factors for significantly intense reflections | 0.0481 |
Weighted residual factors for all reflections included in the refinement | 0.0494 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
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/4070509.html
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Users of the data should acknowledge the original authors of the
structural data.