Information card for entry 4061471

Structure parameters

• Common name: [Ru(η^5^C~5~Me~5~)(H~2~){(Κ^2^-P,P')-^i^Pr~2~PNHCH~2~CH~2~NHP^i^Pr~2~}] [B{(C~6~H~3~(CF~3~)~2~}~4~].C~6~H~5~F
• Formula: C61 H63 B2 F25 N8 P2 Ru
• Calculated formula: C61 H63 B2 F25 N8 P2 Ru
• SMILES: [RuH2]123([P](NCCN[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)[n]1[n]([BH]([n]4[n]2ccc4)[n]2[n]3ccc2)ccc1.c1(cc(cc(c1)C(F)(F)F)C(F)(F)F)[B-](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F.c1(ccccc1)F
• Authors of publication: Manuel Jiménez-Tenorio; M. Dolores Palacios Tejero; M.Carmen Puerta; Pedro Valerga
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 12.6791 ± 0.0013 Å
• b: 14.0536 ± 0.0013 Å
• c: 19.25 ± 0.002 Å
• α: 86.926 ± 0.002°
• β: 79.169 ± 0.002°
• γ: 87.394 ± 0.002°
• Cell volume: 3361.9 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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