Information card for entry 4111268

Structure parameters

• Formula: C34 H24 N6 Zn
• Calculated formula: C34 H24 N6 Zn
• Title of publication: TCNQ Dianion-Based Coordination Polymer Whose Open Framework Shows Charge-Transfer Type Guest Inclusion
• Authors of publication: Satoru Shimomura; Ryotaro Matsuda; Takashi Tsujino; Takashi Kawamura; Susumu Kitagawa
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 16416 - 16417
• a: 12.384 ± 0.002 Å
• b: 12.384 ± 0.002 Å
• c: 22.765 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3491.3 ± 0.9 ų
• Cell temperature: 273.1 K
• Number of distinct elements: 4
• Space group number: 140
• Hermann-Mauguin space group symbol: I 4/m c m
• Hall space group symbol: -I 4 2c
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for all reflections included in the refinement: 0.07
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No