Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7102924
Preview
Coordinates | 7102924.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | ((BP2)Cu(NHMes))(Li(12-C-4)2) |
---|---|
Formula | C60 H106 B Cu Li N O8 P2 |
Calculated formula | C60 H106 B Cu Li N O8 P2 |
SMILES | [Cu]1([P](C[B](c2ccccc2)(c2ccccc2)C[P]1(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)Nc1c(cc(cc1C)C)C.[Li+]123456([O]7CC[O]1CC[O]2CC[O]3CC7)[O]1CC[O]4CC[O]5CC[O]6CC1.CCCCC |
Title of publication | Diazoalkanes react with a bis(phosphino)borate copper(i) source to generate [Ph2BP(tBu)2]Cu(eta1-N2CR2), [Ph2BP(tBu)2]Cu(CPh2), and [Ph2BP(tBu)2]Cu-N(CPh2)(NCPh2). |
Authors of publication | Mankad, Neal P; Peters, Jonas C |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2008 |
Journal issue | 9 |
Pages of publication | 1061 - 1063 |
a | 11.9146 ± 0.0009 Å |
b | 21.3858 ± 0.0016 Å |
c | 24.4619 ± 0.0018 Å |
α | 90° |
β | 92.556 ± 0.001° |
γ | 90° |
Cell volume | 6226.8 ± 0.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.111 |
Residual factor for significantly intense reflections | 0.0603 |
Weighted residual factors for significantly intense reflections | 0.0917 |
Weighted residual factors for all reflections included in the refinement | 0.0962 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.725 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7102924.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.