Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1557370
Preview
Coordinates | 1557370.cif |
---|---|
Structure factors | 1557370.hkl |
Original IUCr paper | HTML |
Chemical name | 6-[(<i>tert</i>-Butyldimethylsilyl)oxy]-3-ethenyl-7-methoxy-4-[(trimethylsilyl)ethynyl]naphtho[2,3-<i>c</i>]furan-1(3<i>H</i>)-one |
---|---|
Formula | C26 H34 O4 Si2 |
Calculated formula | C26 H34 O4 Si2 |
Title of publication | 6-[(<i>tert</i>-Butyldimethylsilyl)oxy]-3-ethenyl-7-methoxy-4-[(trimethylsilyl)ethynyl]naphtho[2,3-<i>c</i>]furan-1(3<i>H</i>)-one |
Authors of publication | Weil, Matthias; Kremsmayr, Thomas; Mihovilovic, Marko D. |
Journal of publication | IUCrData |
Year of publication | 2020 |
Journal volume | 5 |
Journal issue | 2 |
Pages of publication | x200224 |
a | 10.2628 ± 0.0006 Å |
b | 20.5653 ± 0.0013 Å |
c | 13.3923 ± 0.0008 Å |
α | 90° |
β | 111.638 ± 0.0015° |
γ | 90° |
Cell volume | 2627.4 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0591 |
Residual factor for significantly intense reflections | 0.0408 |
Weighted residual factors for significantly intense reflections | 0.0955 |
Weighted residual factors for all reflections included in the refinement | 0.1042 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
248402 (current) | 2020-02-22 | cif/ hkl/ Adding structures of 1557370 via cif-deposit CGI script. |
1557370.cif 1557370.hkl |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.