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Information card for entry 4110315
Preview
Coordinates | 4110315.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Compound 10 |
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Formula | C80 H104 Sn2 |
Calculated formula | C80 H104 Sn2 |
SMILES | C(C)(c1c(c2c([Sn]3[H][Sn](c4c(cc(cc4c4c(cccc4C(C)C)C(C)C)C(C)(C)C)c4c(cccc4C(C)C)C(C)C)[H]3)c(cc(c2)C(C)(C)C)c2c(cccc2C(C)C)C(C)C)c(ccc1)C(C)C)C.c1ccccc1.c1ccccc1 |
Title of publication | Isomeric Forms of Heavier Main Group Hydrides: Experimental and Theoretical Studies of the [Sn(Ar)H]2 (Ar = Terphenyl) System |
Authors of publication | Eric Rivard; Roland C. Fischer; Robert Wolf; Yang Peng; W. Alexander Merrill; Nathan D. Schley; Zhongliang Zhu; Lihung Pu; James C. Fettinger; Simon J. Teat; Isreal Nowik; Rolfe H. Herber; Nozomi Takagi; Shigeru Nagase; Philip P. Power |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2007 |
Journal volume | 129 |
Pages of publication | 16197 - 16208 |
a | 17.488 ± 0.003 Å |
b | 11.6926 ± 0.0017 Å |
c | 17.666 ± 0.003 Å |
α | 90° |
β | 94.351 ± 0.003° |
γ | 90° |
Cell volume | 3601.9 ± 1 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 2 K |
Number of distinct elements | 3 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1089 |
Residual factor for significantly intense reflections | 0.0674 |
Weighted residual factors for significantly intense reflections | 0.1629 |
Weighted residual factors for all reflections included in the refinement | 0.187 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4110315.html
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