Information card for entry 7110968

Structure parameters

• Formula: C10 H16 Cr Cu K N10
• Calculated formula: C10 H16 Cr Cu K N10
• SMILES: C(#N)[Cr](C#N)(C#N)(C#N)(C#N)C#N.C1[NH2][Cu]2([NH2]CC[NH2]2)[NH2]C1.[K+]
• Title of publication: An unusual three-dimensional porous framework complex {[Cu(en)2][KCr(CN)6]}∞(en = ethylenediamine) from a template self-assembly reaction
• Authors of publication: Yuan, Aihua; Li, Baolong; Zha, Zhenggen; Duan, Chunying; Liu, Yongjian; Xu, Zheng; Zou, Jianzhong; Keizer, Steven
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 14
• Pages of publication: 1297
• a: 8.5237 ± 0.0012 Å
• b: 17.014 ± 0.003 Å
• c: 12.103 ± 0.002 Å
• α: 90°
• β: 98.7 ± 0.02°
• γ: 90°
• Cell volume: 1735 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0578
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for all reflections: 0.1533
• Weighted residual factors for significantly intense reflections: 0.1491
• Goodness-of-fit parameter for all reflections: 1.096
• Goodness-of-fit parameter for significantly intense reflections: 1.137
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No