Information card for entry 4114232

Structure parameters

• Formula: C298.2 H346.8 Cl6.7 N24 O12.3 Zn6
• Calculated formula: C298.2 H323.5 Cl6.7 N24 O12.3 Zn6
• Title of publication: Hexagonal Columnar Porphyrin Assembly by Unique Trimeric Complexation of a Porphyrin Dimer with π-π Stacking: Remarkable Thermal Behavior in a Solid
• Authors of publication: Hidemitsu Uno; Akane Masumoto; Noboru Ono
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 12082 - 12083
• a: 22.74 ± 0.004 Å
• b: 22.735 ± 0.003 Å
• c: 30.569 ± 0.005 Å
• α: 74.971 ± 0.005°
• β: 88.762 ± 0.006°
• γ: 59.955 ± 0.004°
• Cell volume: 13101 ± 4 ų
• Cell temperature: 123.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.14
• Goodness-of-fit parameter for all reflections included in the refinement: 1.853
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No