Information card for entry 7013616

Structure parameters

• Formula: C68 H54 Ag F6 N4 O4 P
• Calculated formula: C68 H54 Ag F6 N4 O4 P
• SMILES: [P](F)(F)(F)(F)(F)[F-].[Ag]([N]#Cc1cc(C(=C\2C=C(C=C2C(=O)c2cc(ccc2)C#N)[C@@](c2ccccc2)(C)CC)\O)ccc1)[N]#Cc1cc(/C(=C2/C=C(C=C2C(=O)c2cc(ccc2)C#N)[C@](c2ccccc2)(C)CC)O)ccc1.c1ccccc1
• Title of publication: New Ag(i) inorganic?organic coordination polymers and M(ii) (M = Co(ii) and Mn(ii)) molecular complexes generated from a new type of fulvene ligand
• Authors of publication: Dong, Yu-Bin; Ma, Jian-Ping; Jin, Guo-Xia; Huang, Ru-Qi; Smith, Mark D.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 22
• Pages of publication: 4324
• a: 8.209 ± 0.003 Å
• b: 11.951 ± 0.004 Å
• c: 15.384 ± 0.005 Å
• α: 103.007 ± 0.006°
• β: 94.673 ± 0.006°
• γ: 94.643 ± 0.006°
• Cell volume: 1458 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1804
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.0951
• Weighted residual factors for all reflections included in the refinement: 0.1211
• Goodness-of-fit parameter for all reflections included in the refinement: 0.74
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No