Information card for entry 7051237

Structure parameters

• Formula: C19 H29 Cl N2 O10
• Calculated formula: C19 H29 Cl N2 O10
• SMILES: C1COCCOCCOCCOCCOc2ccccc2O1.c1[nH]cc[nH+]1.Cl(=O)(=O)(=O)[O-]
• Title of publication: Complexation of planar, organic, five-membered cations with crown ethers
• Authors of publication: Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni
• Journal of publication: New Journal of Chemistry
• Year of publication: 2000
• Journal volume: 24
• Journal issue: 1
• Pages of publication: 47 - 52
• a: 9.799 ± 0.0002 Å
• b: 37.641 ± 0.001 Å
• c: 12.3724 ± 0.0003 Å
• α: 90°
• β: 93.016 ± 0.001°
• γ: 90°
• Cell volume: 4557.17 ± 0.19 ų
• Cell temperature: 173 ± 0.2 K
• Ambient diffraction temperature: 173 ± 0.2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No