Information card for entry 4062023

Structure parameters

• Formula: C23 H39 N3 Ru
• Calculated formula: C23 H39 N3 Ru
• SMILES: [Ru]123([CH]4=[CH]1CC[CH]2=[CH]3CC4)(C#[N]C(C)(C)C)(C#[N]C(C)(C)C)C#[N]C(C)(C)C
• Title of publication: Ligand Displacement Reaction of Ru(η^4^-1,5-COD)(η^6^-1,3,5-COT) with Lewis Bases
• Authors of publication: Masafumi Hirano; Rie Asakawa; Chifumi Nagata; Takashi Miyasaka; Nobuyuki Komine; Sanshiro Komiya
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Pages of publication: 2378
• a: 29.03 ± 0.006 Å
• b: 9.726 ± 0.006 Å
• c: 19.438 ± 0.006 Å
• α: 90°
• β: 116.96 ± 0.02°
• γ: 90°
• Cell volume: 4891 ± 3 ų
• Cell temperature: 200.2 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No