Information card for entry 7216912
Common name |
Methyl (2E,4S,5S)-4-chloro-5-(4-methylphenylsulfonylamino)hex-2-enoate |
Formula |
C14 H18 Cl N O4 S |
Calculated formula |
C14 H18 Cl N O4 S |
Title of publication |
Stereoselective synthesis of a set of two functionalized (E)-alkene dipeptide isosteres of L-amino acid-L-Glu and L-amino acid-D-Glu |
Authors of publication |
Oishi, Shinya; Tamamura, Hirokazu; Yamashita, Masaki; Odagaki, Yoshihiko; Hamanaka, Nobuyuki; Otaka, Akira; Fujii, Nobutaka |
Journal of publication |
Journal of the Chemical Society, Perkin Transactions 1 |
Year of publication |
2001 |
Journal issue |
19 |
Pages of publication |
2445 |
a |
9.685 ± 0.004 Å |
b |
21.585 ± 0.005 Å |
c |
7.745 ± 0.004 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
1619.1 ± 1.1 Å3 |
Cell temperature |
296.2 K |
Ambient diffraction temperature |
296.2 K |
Number of distinct elements |
6 |
Space group number |
19 |
Hermann-Mauguin space group symbol |
P 21 21 21 |
Hall space group symbol |
P 2ac 2ab |
Residual factor for significantly intense reflections |
0.0519 |
Weighted residual factors for significantly intense reflections |
0.0656 |
Goodness-of-fit parameter for significantly intense reflections |
5.24 |
Diffraction radiation wavelength |
1.5418 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/7216912.html