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Information card for entry 4070507
Preview
Coordinates | 4070507.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H36 B8 P2 Pt |
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Calculated formula | C27 H36 B8 P2 Pt |
SMILES | [Pt]123([P](c4ccccc4)(c4ccccc4)CC[P]1(c1ccccc1)c1ccccc1)[BH]145[BH]678[BH]9%10%11[CH2]([BH]%127%10[BH]358[H]%12)[BH]35%11[BH]169[BH]243[H]5 |
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 | 11.4458 ± 0.0003 Å |
b | 20.8605 ± 0.0005 Å |
c | 16.5321 ± 0.0004 Å |
α | 90° |
β | 123.187 ± 0.001° |
γ | 90° |
Cell volume | 3303.44 ± 0.15 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0379 |
Residual factor for significantly intense reflections | 0.0285 |
Weighted residual factors for significantly intense reflections | 0.0569 |
Weighted residual factors for all reflections included in the refinement | 0.0598 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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