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Information card for entry 7026221
Preview
Coordinates | 7026221.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C76 H100 Au2 N4 O3 |
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Calculated formula | C76 H100 Au2 N4 O3 |
SMILES | [Au](C#Cc1cc(C#C[Au]=C2N(C=CN2c2c(cccc2C(C)C)C(C)C)c2c(cccc2C(C)C)C(C)C)ccc1)=C1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C.O1CCCC1.O1CCCC1.O1CCCC1 |
Title of publication | A versatile gold synthon for acetylene C-H bond activation. |
Authors of publication | Fortman, George C.; Poater, Albert; Levell, Jack W.; Gaillard, Sylvain; Slawin, Alexandra M. Z.; Samuel, Ifor D. W.; Cavallo, Luigi; Nolan, Steven P. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 43 |
Pages of publication | 10382 - 10390 |
a | 26.957 ± 0.007 Å |
b | 15.707 ± 0.004 Å |
c | 16.66 ± 0.004 Å |
α | 90° |
β | 96.742 ± 0.008° |
γ | 90° |
Cell volume | 7005 ± 3 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 5 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0471 |
Residual factor for significantly intense reflections | 0.0457 |
Weighted residual factors for significantly intense reflections | 0.1165 |
Weighted residual factors for all reflections included in the refinement | 0.118 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
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/7026221.html
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