Information card for entry 8100990
Formula |
C14 H21 N3 O Si |
Calculated formula |
C14 H21 N3 O Si |
SMILES |
[Si]([C@@H]1[C@H](O)Cc2c(N3N=NC[C@@H]13)cccc2)(C)(C)C |
Title of publication |
Crystal structure of (3aS,4S,5R)-4-trimethylsilyl-3a,4,5,6-tetrahydro- 3H-1,2,10b-triaza-benzo[e]azulen-5-ol, C~14~H~21~N~3~OSi |
Authors of publication |
Ducray, Richard; Grosvalet, Laurent; Ciufolini, Marco A.; Perrin, Monique |
Journal of publication |
Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication |
2001 |
Journal volume |
216 |
Journal issue |
3 |
Pages of publication |
347 - 348 |
a |
7.946 ± 0.0016 Å |
b |
12.255 ± 0.003 Å |
c |
15.389 ± 0.003 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
1498.6 ± 0.5 Å3 |
Cell temperature |
173 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
5 |
Space group number |
19 |
Hermann-Mauguin space group symbol |
P 21 21 21 |
Hall space group symbol |
P 2ac 2ab |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/8100990.html