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Information card for entry 7034533
Preview
| Coordinates | 7034533.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C33 H30 Cd Cl2 N4 O11 |
|---|---|
| Calculated formula | C33 H30 Cd Cl2 N4 O11 |
| SMILES | [Cd]1234[O](c5cccc6ccc([n]2c56)C[N]1(Cc1[n]3c2c(OC)cccc2cc1)Cc1[n]4c2c(OC)cccc2cc1)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-] |
| Title of publication | Tris(8-methoxy-2-quinolylmethyl)amine (8-MeOTQA) as a highly fluorescent Zn(2+) probe prepared by convenient C3-symmetric tripodal amine synthesis. |
| Authors of publication | Mikata, Yuji; Nodomi, Yuki; Ohnishi, Risa; Kizu, Asako; Konno, Hideo |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 17 |
| Pages of publication | 8021 - 8030 |
| a | 18.248 ± 0.005 Å |
| b | 11.367 ± 0.003 Å |
| c | 15.943 ± 0.004 Å |
| α | 90° |
| β | 95.105 ± 0.003° |
| γ | 90° |
| Cell volume | 3293.9 ± 1.5 Å3 |
| Cell temperature | 153 K |
| Ambient diffraction temperature | 153 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0506 |
| Residual factor for significantly intense reflections | 0.0453 |
| Weighted residual factors for significantly intense reflections | 0.1141 |
| Weighted residual factors for all reflections included in the refinement | 0.1185 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301849 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/03/ Each referenced PubChem compound corresponds to the full crystal structure. |
7034533.cif |
| 180051 | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/45. |
7034533.cif |
| 138736 | 2015-06-07 | cif/ Updating files of 7034530, 7034531, 7034532, 7034533, 7034534, 7034535, 7034536 Original log message: Adding full bibliography for 7034530--7034536.cif. |
7034533.cif |
| 134308 | 2015-03-24 | cif/ Adding structures of 7034530, 7034531, 7034532, 7034533, 7034534, 7034535, 7034536 via cif-deposit CGI script. |
7034533.cif |
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Users of the data should acknowledge the original authors of the
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