Information card for entry 4349654
| Formula |
C68 H38 F10 N6 |
| Calculated formula |
C68 H38 F10 N6 |
| Title of publication |
Donor‒acceptor type A2B2 porphyrins: synthesis, energy transfer, computational and electrochemical studies |
| Authors of publication |
Das, Sudipta; Bhat, Haamid R.; Balsukuri, Naresh; Jha, Prakash C.; Hisamune, Yutaka; Ishida, Masatosi; Furuta, Hiroyuki; Mori, Shigeki; Gupta, Iti |
| Journal of publication |
Inorganic Chemistry Frontiers |
| Year of publication |
2017 |
| Journal volume |
4 |
| Journal issue |
4 |
| Pages of publication |
618 |
| a |
15.23 ± 0.007 Å |
| b |
13.289 ± 0.006 Å |
| c |
30.036 ± 0.015 Å |
| α |
90° |
| β |
90.567 ± 0.007° |
| γ |
90° |
| Cell volume |
6079 ± 5 Å3 |
| Cell temperature |
100 ± 2 K |
| Ambient diffraction temperature |
100 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
4 |
| Hermann-Mauguin space group symbol |
P 1 21 1 |
| Hall space group symbol |
P 2yb |
| Residual factor for all reflections |
0.1162 |
| Residual factor for significantly intense reflections |
0.0972 |
| Weighted residual factors for significantly intense reflections |
0.2272 |
| Weighted residual factors for all reflections included in the refinement |
0.2422 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.074 |
| Diffraction radiation wavelength |
0.71075 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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