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Information card for entry 7029580
Preview
Coordinates | 7029580.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H54 O Sr |
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Calculated formula | C30 H54 O Sr |
SMILES | [Sr]12345678([O]9CCCC9)([CH2]=[C]1([CH]2=[C]3(C4)C(C)(C)C)C(C)(C)C)[CH2]=[C]5([CH]6=[C]7(C8)C(C)(C)C)C(C)(C)C |
Title of publication | Pentadienyl chemistry of the heavy alkaline-earth metals revisited. |
Authors of publication | Reiners, Matthias; Fecker, Ann Christin; Freytag, Matthias; Jones, Peter G.; Walter, Marc D. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 18 |
Pages of publication | 6614 - 6617 |
a | 9.7948 ± 0.0005 Å |
b | 14.1834 ± 0.0005 Å |
c | 23.3962 ± 0.001 Å |
α | 88.549 ± 0.003° |
β | 79.821 ± 0.002° |
γ | 71.131 ± 0.002° |
Cell volume | 3025.4 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1022 |
Residual factor for significantly intense reflections | 0.0544 |
Weighted residual factors for significantly intense reflections | 0.0724 |
Weighted residual factors for all reflections included in the refinement | 0.0825 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
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/7029580.html
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Users of the data should acknowledge the original authors of the
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