Information card for entry 8101124

Structure parameters

• Formula: C7 H9 Cl N4 O4 S
• Calculated formula: C7 H9 Cl N4 O4 S
• SMILES: Cl(=O)(=O)(=O)[O-].S=C(N/N=C/c1[nH+]cccc1)N
• Title of publication: Crystal structure of pyridine-2-carbaldehyde thiosemicarbazonium perchlorate, (C~7~H~9~N~4~S)(ClO~4~)
• Authors of publication: Morsali, Ali; Ramazani, Ali; Jamali, Fahimeh; Gouranlou, Farideh
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 4
• Pages of publication: 607 - 608
• a: 7.556 ± 0.0011 Å
• b: 8.6238 ± 0.0012 Å
• c: 8.9656 ± 0.0013 Å
• α: 104.836 ± 0.003°
• β: 99.612 ± 0.003°
• γ: 101.635 ± 0.003°
• Cell volume: 538.18 ± 0.13 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No