Information card for entry 8100008

Structure parameters

• Common name: Sodium p-azidobenzenesulfonate
• Formula: C6 H4 N3 Na O3 S
• Calculated formula: C6 H4 N3 Na O3 S
• SMILES: [Na+].S(=O)(=O)([O-])c1ccc(cc1)N=N#N
• Title of publication: Crystal structure of sodium 4-azidobenzenesulfonate, Na[N~3~C~6~H~4~SO~3~]
• Authors of publication: Biesemeier, Frank; Harms, Klaus; Müller, Ulrich
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2004
• Journal volume: 219
• Journal issue: 1
• Pages of publication: 37 - 38
• a: 17.816 ± 0.001 Å
• b: 8.3131 ± 0.0007 Å
• c: 5.9366 ± 0.0005 Å
• α: 90°
• β: 93.061 ± 0.006°
• γ: 90°
• Cell volume: 878 ± 0.1 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• 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