Information card for entry 4063053

Structure parameters

• Formula: C62 H88 Mn2 N4 O4
• Calculated formula: C62 H88 Mn2 N4 O4
• SMILES: [Mn]12(OC(=[O][Mn]3(OC(=[O]1)C)[N](=C(C=C(N3c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C)C)[N](=C(C=C(N2c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Synthesis, Structure, and Reactivity of β-Diketiminate Complexes of Manganese(II)
• Authors of publication: Chai, Jianfang; Zhu, Hongping; Roesky, Herbert W.; He, Cheng; Schmidt, Hans-Georg; Noltemeyer, Mathias
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 13
• Pages of publication: 3284 - 3289
• a: 17.32 ± 0.03 Å
• b: 15.21 ± 0.017 Å
• c: 23.3 ± 0.03 Å
• α: 90°
• β: 101.94 ± 0.06°
• γ: 90°
• Cell volume: 6007 ± 15 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No