Information card for entry 7027073

Structure parameters

• Formula: C142 H124 Ag2 B2 N2 P6 S3
• Calculated formula: C142 H118 Ag2 B2 N2 P6 S3
• SMILES: [B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.c1(ccccc1)[P]1(c2ccccc2)[Ag]2[P](c3ccccc3)(c3ccccc3)Cc3sc(C[P]([Ag]([P](c4ccccc4)(c4ccccc4)Cc4sc(C1)cc4)[P](c1ccccc1)(c1ccccc1)Cc1sc(C[P]2(c2ccccc2)c2ccccc2)cc1)(c1ccccc1)c1ccccc1)cc3.C(#N)C.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.C(#N)C
• Title of publication: Structural diversity in silver(I) and gold(I) complexes with 2,5-bis(diphenylphosphinomethyl)thiophene
• Authors of publication: Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 23
• Pages of publication: 4035
• a: 37.999 ± 0.004 Å
• b: 14.5278 ± 0.0013 Å
• c: 28.107 ± 0.003 Å
• α: 90°
• β: 127.974 ± 0.009°
• γ: 90°
• Cell volume: 12231 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0525
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for all reflections: 0.0979
• Weighted residual factors for significantly intense reflections: 0.0869
• Goodness-of-fit parameter for all reflections: 1.057
• Goodness-of-fit parameter for significantly intense reflections: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No