Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7009541
Preview
Coordinates | 7009541.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [In(P2C3tBu3)] |
---|---|
Formula | C15 H27 In P2 |
Calculated formula | C7.5 H13.5 In0.5 P |
Title of publication | A study of the molecular and electronic structures of the indium(I) phospholyls [In(η5-P2C3But3)] and [In(η5-P3C2But2)] by X-ray diffraction, photoelectron spectroscopy and density functional theory |
Authors of publication | Guy K. B. Clentsmith; F. Geoffrey N. Cloke; Matthew D. Francis; Jennifer C. Green,; Peter B. Hitchcock; John F. Nixon; James L. Suter; David M. Vickers |
Journal of publication | J. Chem. Soc., Dalton Trans. |
Year of publication | 2000 |
Journal issue | 11 |
Pages of publication | 1715 - 1721 |
a | 6.144 ± 0.004 Å |
b | 11.233 ± 0.006 Å |
c | 13.461 ± 0.007 Å |
α | 112.48 ± 0.04° |
β | 93.13 ± 0.05° |
γ | 90.09 ± 0.05° |
Cell volume | 856.9 ± 0.9 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1069 |
Residual factor for significantly intense reflections | 0.0682 |
Weighted residual factors for significantly intense reflections | 0.1542 |
Weighted residual factors for all reflections included in the refinement | 0.1727 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7009541.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.