Information card for entry 7225654

Structure parameters

• Common name: tertiary amine salt
• Formula: C21 H35 N7 O6
• Calculated formula: C21 H35 N7 O6
• SMILES: N(CCN(C)Cc1cc([NH3+])ccc1)(CCN(Cc1cc([NH3+])ccc1)C)C.N(=O)(=O)[O-].N(=O)(=O)[O-]
• Title of publication: The Salt-Based Catalytic Enhancement of CO2 Absorption by a Tertiary Amine Medium
• Authors of publication: Dharmalingam, Sivanesan; Kim, Young Eun; Youn, Min Hye; Park, Ki Tae; Kim, Hak Ju; Nirmala Grace, A.; Jeong, Soon Kwan
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 14.3139 ± 0.0005 Å
• b: 16.859 ± 0.0005 Å
• c: 10.2559 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2474.93 ± 0.15 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1074
• Goodness-of-fit parameter for all reflections included in the refinement: 0.755
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No