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Information card for entry 7158187
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Coordinates | 7158187.cif |
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Original paper (by DOI) | HTML |
Formula | C26 H25 N2 O5 P |
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Calculated formula | C26 H25 N2 O5 P |
Title of publication | PMDTA-catalyzed multicomponent synthesis and biological activity of 2-amino-4H-chromenes containing a phosphonate or phosphine oxide moiety. |
Authors of publication | Tajti, Ádám; Szabó, Kármen Emőke; Popovics-Tóth, Nóra; Iskanderov, Javad; Perdih, Franc; Hackler, László; Kari, Beáta; Puskás, László G; Bálint, Erika |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2021 |
Journal volume | 19 |
Journal issue | 31 |
Pages of publication | 6883 - 6891 |
a | 9.9066 ± 0.0004 Å |
b | 9.9454 ± 0.0004 Å |
c | 12.3415 ± 0.0006 Å |
α | 102.791 ± 0.004° |
β | 101.823 ± 0.004° |
γ | 90.163 ± 0.003° |
Cell volume | 1159.14 ± 0.09 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 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 | 0.0442 |
Residual factor for significantly intense reflections | 0.0417 |
Weighted residual factors for significantly intense reflections | 0.113 |
Weighted residual factors for all reflections included in the refinement | 0.1163 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
268948 (current) | 2021-09-06 | cif/ Updating files of 7158185, 7158186, 7158187, 7158188, 7158189 Original log message: Adding full bibliography for 7158185--7158189.cif. |
7158187.cif |
267720 | 2021-07-23 | cif/ Adding structures of 7158185, 7158186, 7158187, 7158188, 7158189 via cif-deposit CGI script. |
7158187.cif |
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Users of the data should acknowledge the original authors of the
structural data.