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Information card for entry 4080210
Preview
Coordinates | 4080210.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C86.5 H98 I N4 O2 P4 Si4 Y |
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Calculated formula | C83 H94 I N4 O2 P4 Si4 Y |
SMILES | [Y]12(I)([N](=P(C(P(c3ccccc3)(c3ccccc3)=N[Si](C)(C)C)=C(O2)c2ccccc2)(c2ccccc2)c2ccccc2)[Si](C)(C)C)[N](=P(C(=C(O1)c1ccccc1)P(c1ccccc1)(c1ccccc1)=N[Si](C)(C)C)(c1ccccc1)c1ccccc1)[Si](C)(C)C.Cc1ccccc1 |
Title of publication | Reactivity Studies of a T-Shaped Yttrium Carbene: C‒F and C‒O Bond Activation and C═C Bond Formation Promoted by [Y(BIPM)(I)(THF)2] (BIPM = C(PPh2NSiMe3)2) |
Authors of publication | Mills, David P.; Lewis, William; Blake, Alexander J.; Liddle, Stephen T. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 5 |
Pages of publication | 1239 |
a | 12.4201 ± 0.0003 Å |
b | 16.6524 ± 0.0004 Å |
c | 22.1146 ± 0.0003 Å |
α | 83.0555 ± 0.0016° |
β | 82.7864 ± 0.0015° |
γ | 69.759 ± 0.002° |
Cell volume | 4242.65 ± 0.17 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 2 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0623 |
Residual factor for significantly intense reflections | 0.0479 |
Weighted residual factors for significantly intense reflections | 0.113 |
Weighted residual factors for all reflections included in the refinement | 0.12 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/4080210.html
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