Information card for entry 2237197
Chemical name |
2,2,7,7-Tetramethyl-1,2,3,4,5,6,7,8-octahydroacridine-1,8-dione |
Formula |
C17 H21 N O2 |
Calculated formula |
C17 H21 N O2 |
SMILES |
c12CCC(C(=O)c1cc1c(n2)CCC(C1=O)(C)C)(C)C |
Title of publication |
2,2,7,7-Tetramethyl-1,2,3,4,5,6,7,8-octahydroacridine-1,8-dione |
Authors of publication |
Öztürk Yildirim, Sema; Butcher, Ray J.; Şimsek, Rahime; El-Khouly, Ahmed; Şafak, Cihat |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2013 |
Journal volume |
69 |
Journal issue |
1 |
Pages of publication |
o88 - o89 |
a |
9.99077 ± 0.00019 Å |
b |
9.99077 ± 0.00019 Å |
c |
14.5063 ± 0.0004 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
1447.95 ± 0.06 Å3 |
Cell temperature |
123 ± 2 K |
Ambient diffraction temperature |
123 ± 2 K |
Number of distinct elements |
4 |
Space group number |
95 |
Hermann-Mauguin space group symbol |
P 43 2 2 |
Hall space group symbol |
P 4cw 2c |
Residual factor for all reflections |
0.0472 |
Residual factor for significantly intense reflections |
0.0431 |
Weighted residual factors for significantly intense reflections |
0.116 |
Weighted residual factors for all reflections included in the refinement |
0.1219 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.09 |
Diffraction radiation wavelength |
1.54184 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/2237197.html