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Information card for entry 7701786
Preview
| Coordinates | 7701786.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C47 H49 Cl3 N6 O16 Zn2 |
|---|---|
| Calculated formula | C47 H49 Cl3 N6 O16 Zn2 |
| Title of publication | Methoxy-substituted tetrakisquinoline analogs of EGTA and BAPTA for fluorescence detection of Cd<sup>2+</sup> . |
| Authors of publication | Mikata, Yuji; Kaneda, Minori; Konno, Hideo; Matsumoto, Arimasa; Sato, Shin-Ichiro; Kawamura, Masaya; Iwatsuki, Satoshi |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 12 |
| Pages of publication | 3840 - 3852 |
| a | 11.9135 ± 0.0001 Å |
| b | 12.4419 ± 0.0001 Å |
| c | 17.5021 ± 0.0002 Å |
| α | 78.577 ± 0.003° |
| β | 79.314 ± 0.003° |
| γ | 78.273 ± 0.004° |
| Cell volume | 2461.16 ± 0.06 Å3 |
| Cell temperature | 153 K |
| Ambient diffraction temperature | 153 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 | 0.0437 |
| Residual factor for significantly intense reflections | 0.0405 |
| Weighted residual factors for significantly intense reflections | 0.1077 |
| Weighted residual factors for all reflections included in the refinement | 0.1108 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7701786.cif |
| 223359 | 2019-11-05 | cif/ Adding structures of 7701784, 7701785, 7701786, 7701787, 7701788, 7701789, 7701790, 7701791, 7701792, 7701793 via cif-deposit CGI script. |
7701786.cif |
All data in the COD and the database itself are dedicated to the
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CC0
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.
Users of the data should acknowledge the original authors of the
structural data.