Information card for entry 2104526

Structure parameters

• Chemical name: N,N'-bis(3-((5-Ethoxycarbonyl)-2,4-dimethoxyphenylaminocarbonyl)-4,6- diisopropylphenyl)-N,N'-bis(2,4-dimethoxybenzyl)-4,6-bis(isobutoxy)benzene- 1,3-diamide methanol solvate.
• Formula: C88 H118 N4 O24
• Calculated formula: C88 H118 N4 O24
• SMILES: CCOC(=O)c1cc(NC(=O)c2cc(c(cc2OCC(C)C)OCC(C)C)N(C(=O)c2cc(c(cc2OCC(C)C)OCC(C)C)C(=O)N(c2cc(c(cc2OCC(C)C)OCC(C)C)C(=O)Nc2cc(C(=O)OCC)c(cc2OC)OC)Cc2ccc(cc2OC)OC)Cc2ccc(cc2OC)OC)c(cc1OC)OC.CO.CO
• Title of publication: Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?
• Authors of publication: Marsh, Richard E.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: 782 - 783
• a: 19.514 ± 0.002 Å
• b: 16.3891 ± 0.0019 Å
• c: 27.727 ± 0.003 Å
• α: 90°
• β: 101.243 ± 0.002°
• γ: 90°
• Cell volume: 8697.4 ± 1.6 ų
• Cell temperature: 203 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No