Information card for entry 7055350
| Formula |
C18 H26 N2 O2 |
| Calculated formula |
C18 H26 N2 O2 |
| SMILES |
C1=C(C([O-])=CC(=O)C1=[NH+]C1CCCCC1)NC1CCCCC1 |
| Title of publication |
Influence of steric hindrance on the molecular packing and the anchoring of quinonoid zwitterions on gold surfaces |
| Authors of publication |
Yuan, Minghui; Tanabe, Iori; Bernard-Schaaf, Jean-Marie; Shi, Qin-Yin; Schlegel, Vicki; Schurhammer, Rachel; Dowben, Peter A.; Doudin, Bernard; Routaboul, Lucie; Braunstein, Pierre |
| Journal of publication |
New J. Chem. |
| Year of publication |
2016 |
| Journal volume |
40 |
| Journal issue |
7 |
| Pages of publication |
5782 |
| a |
11.7927 ± 0.0002 Å |
| b |
11.7927 ± 0.0002 Å |
| c |
25.0037 ± 0.0005 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
3477.21 ± 0.11 Å3 |
| Cell temperature |
193 ± 2 K |
| Ambient diffraction temperature |
193 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
92 |
| Hermann-Mauguin space group symbol |
P 41 21 2 |
| Hall space group symbol |
P 4abw 2nw |
| Residual factor for all reflections |
0.0829 |
| Residual factor for significantly intense reflections |
0.0571 |
| Weighted residual factors for significantly intense reflections |
0.1511 |
| Weighted residual factors for all reflections included in the refinement |
0.1635 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.12 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7055350.html
