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Information card for entry 7706817
Preview
Coordinates | 7706817.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H26 Fe N2 O2 |
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Calculated formula | C24 H26 Fe N2 O2 |
Title of publication | A ferrocene-based pseudopeptide chiroptical switch. |
Authors of publication | Opačak, Saša; Babić, Darko; Perić, Berislav; Marinić, Željko; Smrečki, Vilko; Pem, Barbara; Vinković Vrček, Ivana; Kirin, Srećko I |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 13 |
Pages of publication | 4504 - 4511 |
a | 8.80821 ± 0.00015 Å |
b | 10.91184 ± 0.00019 Å |
c | 11.1489 ± 0.0002 Å |
α | 90° |
β | 105.48 ± 0.0018° |
γ | 90° |
Cell volume | 1032.69 ± 0.03 Å3 |
Cell temperature | 128 ± 5 K |
Ambient diffraction temperature | 128 ± 5 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0363 |
Residual factor for significantly intense reflections | 0.0353 |
Weighted residual factors for significantly intense reflections | 0.0923 |
Weighted residual factors for all reflections included in the refinement | 0.0933 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7706817.html
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Users of the data should acknowledge the original authors of the
structural data.