Information card for entry 2104549

Structure parameters

• Chemical name: 2-Phenyl-1-(4-methoxyphenyl)-5-(5-(tricyanoethenyl)-2-thienyl)pyrrole
• Formula: C26 H16 N4 O S
• Calculated formula: C26 H16 N4 O S
• SMILES: c1(ccc(n1c1ccc(cc1)OC)c1ccccc1)c1ccc(s1)/C(=C(\C#N)C#N)C#N
• 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: 10.911 ± 0.003 Å
• b: 17.863 ± 0.005 Å
• c: 5.573 ± 0.003 Å
• α: 90°
• β: 93.4 ± 0.03°
• γ: 90°
• Cell volume: 1084.3 ± 0.7 ų
• Cell temperature: 298 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No