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Information card for entry 7102334
Preview
Coordinates | 7102334.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H84 B40 N4 O2 Pt |
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Calculated formula | C28 H84 B40 N4 O2 Pt |
SMILES | O([B]1234[BH]567[BH]89%10[BH]%11%125[BH]5%138[BH]8%12([BH]27%11[H]3)[BH]25([BH]%10%13([BH]169[H]4)[H]2)[H]8)[B]1234[BH]567[BH]89%10[BH]%1115[BH]158[BH]8%129[BH]96%10[BH]27([BH]2%129[BH]58([Pt]5673%111[BH]1389[BH]%10%11%12[BH]%13%141[BH]1%15%12[BH]%12%16%11[BH]53%10[BH]37%12[BH2]%15%16([BH]5%131[B]69%14(O[B]1679[BH]%10%11%12[BH]%13%14%15[BH]%16%17%10[BH]%10%18%13[BH]%13%17([BH]86%12%16[H]9)[BH]6%18([BH]%15%10([BH]1%11%14[H]7)[H]6)[H]%13)[H]5)[H]3)[H]2)[H]4.N(c2cccc3cccc([NH+](C)C)c23)(C)C.N(c2cccc3cccc([NH+](C)C)c23)(C)C |
Title of publication | Macropolyhedral boron-containing cluster chemistry. Novel intercluster linkages from the reaction of [Pt(cod)Cl2] and [PtMe2(PMe2Ph)2] with 6,6'-(B10H13)2O. |
Authors of publication | Bould, Jonathan; Kennedy, John D |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2007 |
Journal issue | 47 |
Pages of publication | 5084 - 5086 |
a | 10.7721 ± 0.0004 Å |
b | 13.7551 ± 0.0005 Å |
c | 20.785 ± 0.0007 Å |
α | 90.619 ± 0.002° |
β | 90.784 ± 0.002° |
γ | 104.14 ± 0.002° |
Cell volume | 2985.83 ± 0.18 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 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 all reflections | 0.079 |
Residual factor for significantly intense reflections | 0.0505 |
Weighted residual factors for significantly intense reflections | 0.0952 |
Weighted residual factors for all reflections included in the refinement | 0.1052 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
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/7102334.html
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