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Common molecules sample 50946 - Reciprocal Net Log in
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Empirical formula: C12H25N7O5Cl2
a: 9.213 Å
b: 11.837 Å
c: 18.573 Å
α (alpha): 90.00 °
β (beta): 90.00 °
γ (gamma): 90.00 °
Volume: 2025.47 Å3
Space group: P212121
Calculated density: 1.372 g/cm3
Z: 4
Temperature: 22.0 °C
Formula weight: 418.280 g/mole
R(F): 0.0440
Structural formula: C12H23N7O42+, 2(Cl11-), H2O1
Common name: Saxitoxin ethyl hemiketal dihydrochloride monohydrate
Empirical formula - less solvent: C12H23N7O4
CSD refcode: SAXEKC
Citation of a publication: J.Bordner, W.E.Thiessen, H.A.Bates, H.Rapoport (1975) J.Am.Chem.Soc.,97,6008
Lab name: Common molecules
Sample provider: Obtained courtesy of the Cambridge Structural Database
Status: Complete, visible to public
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