Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7708766
Preview
Coordinates | 7708766.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49 H63 Cl2 O15 Tb Ti2 |
---|---|
Calculated formula | C49 H63 Cl2 O15 Tb Ti2 |
Title of publication | Titanium Compounds Containing Naturally Occurring Dye Molecules |
Authors of publication | Fang, Wei-hui; Muller, Rosa; Jethwa, Rajesh Bharat; Riesgo-González, Victor; Li, Ning; Pike, Sebastian D.; Bond, Andrew David; Luo, He-Kuan; Zhang, Chen; Wright, Dominic S. |
Journal of publication | Dalton Transactions |
Year of publication | 2021 |
a | 15.4971 ± 0.0004 Å |
b | 15.5805 ± 0.0004 Å |
c | 22.8741 ± 0.0006 Å |
α | 85.1389 ± 0.0013° |
β | 79.6785 ± 0.0013° |
γ | 86.4276 ± 0.0014° |
Cell volume | 5407.8 ± 0.2 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0842 |
Residual factor for significantly intense reflections | 0.0603 |
Weighted residual factors for significantly intense reflections | 0.1255 |
Weighted residual factors for all reflections included in the refinement | 0.1404 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
270556 (current) | 2021-11-10 | cif/ Adding structures of 7708763, 7708764, 7708765, 7708766, 7708767, 7708768, 7708769, 7708770 via cif-deposit CGI script. |
7708766.cif |
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.