Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4123395
Preview
| Coordinates | 4123395.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C178 H156 F20 N14 Ni2 |
|---|---|
| Calculated formula | C178 H156 F20 N14 Ni2 |
| Title of publication | meso-meso Linked Porphyrin-[26]Hexaphyrin-Porphyrin Hybrid Arrays and Their Triply Linked Tapes Exhibiting Strong Absorption Bands in the NIR Region. |
| Authors of publication | Mori, Hirotaka; Tanaka, Takayuki; Lee, Sangsu; Lim, Jong Min; Kim, Dongho; Osuka, Atsuhiro |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2015 |
| Journal volume | 137 |
| Journal issue | 5 |
| Pages of publication | 2097 - 2106 |
| a | 14.4663 ± 0.0014 Å |
| b | 20.885 ± 0.002 Å |
| c | 22.059 ± 0.002 Å |
| α | 77.33 ± 0.02° |
| β | 75.06 ± 0.03° |
| γ | 71.62 ± 0.03° |
| Cell volume | 6041.2 ± 1.6 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93 ± 2 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 | 0.1173 |
| Residual factor for significantly intense reflections | 0.1076 |
| Weighted residual factors for significantly intense reflections | 0.3208 |
| Weighted residual factors for all reflections included in the refinement | 0.343 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179035 (current) | 2016-03-22 | cif/4/12/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/12/33. |
4123395.cif |
| 132908 | 2015-03-04 | cif/ Updating files of 4123391, 4123392, 4123393, 4123394, 4123395 Original log message: Adding full bibliography for 4123391--4123395.cif. |
4123395.cif |
| 130612 | 2015-02-04 | cif/ Adding structures of 4123395 via cif-deposit CGI script. |
4123395.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.