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Information card for entry 7020632
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7020632.cif |
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Original paper (by DOI) | HTML |
Formula | C30 H36 B N S Si |
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Calculated formula | C30 H36 B N S Si |
SMILES | s1c([Si](C)(C)C)cc2[B]([n]3c(c12)cccc3)(c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C |
Title of publication | Impact of a dithienyl unit on photostability of N,C-chelating boron compounds. |
Authors of publication | Rao, Ying-Li; Amarne, Hazem; Lu, Jia-Sheng; Wang, Suning |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2013 |
Journal volume | 42 |
Journal issue | 3 |
Pages of publication | 638 - 644 |
a | 8.222 ± 0.0003 Å |
b | 9.0601 ± 0.0003 Å |
c | 18.3261 ± 0.0007 Å |
α | 90° |
β | 99.563 ± 0.002° |
γ | 90° |
Cell volume | 1346.18 ± 0.08 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 6 |
Space group number | 7 |
Hermann-Mauguin space group symbol | P 1 n 1 |
Hall space group symbol | P -2yac |
Residual factor for all reflections | 0.0937 |
Residual factor for significantly intense reflections | 0.0534 |
Weighted residual factors for significantly intense reflections | 0.0954 |
Weighted residual factors for all reflections included in the refinement | 0.1103 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.996 |
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/7020632.html
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