Information card for entry 4062548

Structure parameters

• Common name: [(2,6-Mes2C6H3)2Al]+[B(C6F5)4]-
• Formula: C72 H50 Al B F20
• Calculated formula: C72 H50 Al B F20
• SMILES: [Al]1(c2c(c3c(C)cc(C)cc3C)cccc2c2c(C)cc(C)cc2C)[c]2(c(cc(cc2C)C)C)c2cccc(c12)c1c(C)cc(C)cc1C.[B-](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F
• Title of publication: Synthesis and characterization of an almost linear, quasi-two-coordinate, cationic diorganoaluminum compound Synthesis and characterization of an almost linear, quasi-two-coordinate, cationic diorganoaluminum compound
• Authors of publication: Jackie D. Young; Masood A. Khan; Rudolf J. Wehmschulte
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 17.2959 ± 0.0008 Å
• b: 21.9714 ± 0.001 Å
• c: 31.4784 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11962.3 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No