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Common molecules sample 50948 - Reciprocal Net Log in
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Empirical formula: C11H18N3O8Br1
a: 8.790 Å
b: 9.020 Å
c: 9.510 Å
α (alpha): 106.85 °
β (beta): 88.02 °
γ (gamma): 96.38 °
Volume: 717.16 Å3
Space group: P1
Calculated density: 1.853 g/cm3
Z: 2
Temperature: 22.0 °C
Formula weight: 400.183 g/mole
R(F): 0.1300
Structural formula: C11H18N3O81+, Br11-
Common name: Tetrodotoxin hydrobromide
CSD refcode: TETXHB
Empirical formula - less solvent: C11H18N3O8
Citation of a publication: A.Furusaki, Y.Tomiie, I.Nitta (1970) Bull.Chem.Soc.Jpn., 43,3332
Lab name: Common molecules
Sample provider: Obtained courtesy of the Cambridge Structural Database
Status: Complete, visible to public
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