Information card for entry 7202789

Structure parameters

• Formula: C20 H21 F12 Hg N11 O2 P2
• Calculated formula: C20 H21 F12 Hg N11 O2 P2
• SMILES: [Hg]1(=C2N(C=CN2CC(=O)N)c2[n]1ccnc2)=C1N(C=CN1CC(=O)N)c1nccnc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].N#CC
• Title of publication: Rectangular architectures formed by acyclic diamido-metal-N-heterocyclic carbenes with skewed conformation
• Authors of publication: Lee, Kwang-Ming; Chen, Jack C. C.; Huang, Chao-June; Lin, Ivan J. B.
• Journal of publication: CrystEngComm
• Year of publication: 2007
• Journal volume: 9
• Journal issue: 4
• Pages of publication: 278
• a: 9.1435 ± 0.0016 Å
• b: 11.0699 ± 0.0019 Å
• c: 15.513 ± 0.003 Å
• α: 80.882 ± 0.003°
• β: 80.403 ± 0.003°
• γ: 86.436 ± 0.003°
• Cell volume: 1527.6 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0367
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0747
• Weighted residual factors for all reflections included in the refinement: 0.0768
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No