Information card for entry 7702373

Structure parameters

• Formula: C28 H28 Mn N6 O2 S2
• Calculated formula: C28 H28 Mn N6 O2 S2
• Title of publication: Novel sheet-like manganese(II) networks. Synthesis and structure of [Mn(bpe)(NCS)2(CH3OH)2] and [Mn(bpe)(NCS)2(CH3OH)2]·bpe [bpe = trans-1,2-bis(4-pyridyl)ethene]
• Authors of publication: De Munno, Giovanni; Armentano, Donatella; Poerio, Teresa; Julve, Miguel; Real, José Antonio
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 11
• Pages of publication: 1813
• a: 7.356 ± 0.004 Å
• b: 17.096 ± 0.006 Å
• c: 12.31 ± 0.005 Å
• α: 90°
• β: 93.66 ± 0.04°
• γ: 90°
• Cell volume: 1548.1 ± 1.2 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 12.09
• Residual factor for significantly intense reflections: 7.01
• Weighted residual factors for all reflections: 13.09
• Weighted residual factors for significantly intense reflections: 9.91
• Goodness-of-fit parameter for significantly intense reflections: 1.19
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No