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Information card for entry 8100017
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 8100017.cif |
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Formula | C14 H21 N O2 |
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Calculated formula | C14 H21 N O2 |
SMILES | C1CCN2CC3=CCC(=C[C@H]3[C@]([C@@H]12)(C)O)OC.C1CCN2CC3=CCC(=C[C@@H]3[C@@]([C@H]12)(C)O)OC |
Title of publication | Crystal structure of (9aRS,10SR,10aRS)-8-methoxy-10-methyl-1,2,3,5, 7,9a,10,10a-octahydro pyrrolo-[1,2- b]isoquinoline-10-ol, C~14~H~21~NO~2~ |
Authors of publication | Gross, S.; Brüdgam, I.; Hartl, H.; Reißig, H.-U. |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2004 |
Journal volume | 219 |
Journal issue | 1 |
Pages of publication | 57 - 58 |
a | 10.597 ± 0.002 Å |
b | 12.684 ± 0.003 Å |
c | 9.79 ± 0.002 Å |
α | 90° |
β | 104.466 ± 0.004° |
γ | 90° |
Cell volume | 1274.3 ± 0.5 Å3 |
Cell temperature | 446 ± 2 K |
Ambient diffraction temperature | 446 ± 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 |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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