Information card for entry 2243455

Structure parameters

• Chemical name: <i>cis</i>-Bromidodicarbonyl(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i><i>,N</i>',<i>N</i>'')manganese(I)
• Formula: C23 H15 Br Mn N3 O2
• Calculated formula: C23 H15 Br Mn N3 O2
• Title of publication: Selective synthesis and crystal structures of manganese(I) complexes with a bi- or tridentate terpyridine ligand
• Authors of publication: Wadayama, Kosei; Takase, Tsugiko; Oyama, Dai
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 7
• Pages of publication: 1139 - 1142
• a: 10.497 ± 0.003 Å
• b: 14.123 ± 0.005 Å
• c: 13.504 ± 0.004 Å
• α: 90°
• β: 96.767 ± 0.003°
• γ: 90°
• Cell volume: 1988 ± 1.1 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 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: 0.0519
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.27
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes