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Information card for entry 7105680
Preview
Coordinates | 7105680.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49 H62 N4 P2 S2 Si4 Ta2 |
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Calculated formula | C49 H62 N4 P2 S2 Si4 Ta2 |
SMILES | C1[Si](C)(C)N(c2ccccc2)[Ta]2345(N(c6ccccc6)[Si](C[P]12c1ccccc1)(C)C)C[Ta]125(N(c5ccccc5)[Si](C[P]2(C[Si](C)(C)N1c1ccccc1)c1ccccc1)(C)C)(S3)S4 |
Title of publication | Complete disassembly of carbon disulfide by a ditantalum complex |
Authors of publication | Joachim Ballmann; Alyssa Yeo; Bruce MacKay; Sabine van Rjit; Brian Patrick; Michael Fryzuk |
Journal of publication | Chem.Commun. |
Year of publication | 2010 |
Journal volume | 46 |
Pages of publication | 8794 |
a | 21.9524 ± 0.0008 Å |
b | 21.7688 ± 0.0009 Å |
c | 24.637 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 11773.5 ± 0.8 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0922 |
Residual factor for significantly intense reflections | 0.0368 |
Weighted residual factors for significantly intense reflections | 0.0857 |
Weighted residual factors for all reflections included in the refinement | 0.101 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
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/7105680.html
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