Information card for entry 4062242

Structure parameters

• Formula: C56 H62 N8 O4 Ru2
• Calculated formula: C56 H62 N8 O4 Ru2
• SMILES: C(#Cc1ccccc1)[Ru]1234[N](=C(c5cccc(OC)c5)N([Ru]4(C#Cc4ccccc4)([N](=C(N1C)c1cccc(OC)c1)C)(N(C(=[N]3C)c1cc(OC)ccc1)C)[N](=C(N2C)c1cc(OC)ccc1)C)C)C
• Title of publication: Bis-Adducts of Substituted Phenylethynyl on a Ru~2~(DMBA)~4~ Core: Effect of Donor/Acceptor Modifications
• Authors of publication: Hurst, Stephanie K.; Xu, Guo-Lin; Ren, Tong
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 20
• Pages of publication: 4118 - 4123
• a: 19.8454 ± 0.0016 Å
• b: 15.2222 ± 0.0016 Å
• c: 19.967 ± 0.002 Å
• α: 90°
• β: 116.806 ± 0.003°
• γ: 90°
• Cell volume: 5383.6 ± 0.9 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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