Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4080209
Preview
Coordinates | 4080209.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C106.75 H122 I2 N4 O5 P4 Si4 Y2 |
---|---|
Calculated formula | C98 H112 I2 N4 O5 P4 Si4 Y2 |
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 | 14.0687 ± 0.0006 Å |
b | 16.9323 ± 0.0007 Å |
c | 22.4949 ± 0.0009 Å |
α | 96.996 ± 0.003° |
β | 90.722 ± 0.004° |
γ | 93.541 ± 0.004° |
Cell volume | 5307.5 ± 0.4 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 | 0.0651 |
Residual factor for significantly intense reflections | 0.0579 |
Weighted residual factors for significantly intense reflections | 0.165 |
Weighted residual factors for all reflections included in the refinement | 0.176 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.19 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4080209.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.