Information card for entry 7100313

Structure parameters

• Formula: C38 H38 B2 F8 N10 O4 Pt
• Calculated formula: C38 H38 B2 F8 N10 O4 Pt
• SMILES: [B](F)(F)(F)[F-].c1ccc(c[n]1[Pt]([n]1cccc(c1)c1ccc[nH]1)([n]1cccc(c1)c1[nH]ccc1)[n]1cccc(c1)c1[nH]ccc1)c1ccc[nH]1.N(=O)(=O)C.[B](F)(F)(F)[F-].N(=O)(=O)C
• Title of publication: NH vs. CH hydrogen bond formation in metal-organic anion receptors containing pyrrolylpyridine ligands
• Authors of publication: Philip Gale; Mark E. Light; Stephen Loeb; Ismael El Drubi Vega
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 9.441 ± 0.0003 Å
• b: 10.486 ± 0.0003 Å
• c: 11.247 ± 0.0004 Å
• α: 77.568 ± 0.002°
• β: 89.272 ± 0.002°
• γ: 68.613 ± 0.002°
• Cell volume: 1009.8 ± 0.06 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• 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