Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7111671
Preview
Coordinates | 7111671.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C85 H98 N9 O7 Zn |
---|---|
Calculated formula | C85 H95 N9 O7 Zn |
Title of publication | A lower rim triazole linked calix[4]arene conjugate as a fluorescence switch on sensor for Zn2+ in blood serum milieu |
Authors of publication | Pathak, Rakesh Kumar; Dikundwar, Amol G.; Row, Tayur N. Guru; Rao, Chebrolu Pulla |
Journal of publication | Chemical Communications |
Year of publication | 2010 |
Journal volume | 46 |
Journal issue | 24 |
Pages of publication | 4345 - 4347 |
a | 15.5813 ± 0.0006 Å |
b | 17.2524 ± 0.0005 Å |
c | 18.4381 ± 0.0006 Å |
α | 79.959 ± 0.003° |
β | 65.028 ± 0.004° |
γ | 76.432 ± 0.003° |
Cell volume | 4351.7 ± 0.3 Å3 |
Cell temperature | 150 ± 1 K |
Ambient diffraction temperature | 150 ± 1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0999 |
Residual factor for significantly intense reflections | 0.0659 |
Weighted residual factors for significantly intense reflections | 0.2011 |
Weighted residual factors for all reflections included in the refinement | 0.2189 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.817 |
Diffraction radiation probe | x-ray |
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/7111671.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.