Information card for entry 1543771

Structure parameters

• Formula: C85 H75.5 F12 N10.5 O4 P2 Zn
• Calculated formula: C85 H75.5 F12 N10.5 O4 P2 Zn
• SMILES: [Zn]1234([n]5c(c6[n]1c(cc(c1ccc(/C=C/c7ccc8n(c9c(cccc9)c8c7)CCOCCOC)cc1)c6)c1[n]2cccc1)cccc5)[n]1ccccc1c1[n]3c(c2[n]4cccc2)cc(c1)c1ccc(cc1)/C=C/c1cc2c(n(c3c2cccc3)CCOCCOC)cc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].N#CC.N#CC.N#CC
• Title of publication: Probe for simultaneous membrane and nucleus labeling in living cells and in vivo bioimaging using a two-photon absorption water-soluble Zn(ii) terpyridine complex with a reduced π-conjugation system.
• Authors of publication: Tian, Xiaohe; Zhang, Qiong; Zhang, Mingzhu; Uvdal, Kajsa; Wang, Qin; Chen, Junyang; Du, Wei; Huang, Bei; Wu, Jieying; Tian, Yupeng
• Journal of publication: Chemical science
• Year of publication: 2017
• Journal volume: 8
• Journal issue: 1
• Pages of publication: 142 - 149
• a: 13.732 ± 0.005 Å
• b: 15.892 ± 0.005 Å
• c: 19.26 ± 0.005 Å
• α: 103.178 ± 0.005°
• β: 90.598 ± 0.005°
• γ: 91.07 ± 0.005°
• Cell volume: 4091 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1523
• Residual factor for significantly intense reflections: 0.0847
• Weighted residual factors for significantly intense reflections: 0.2259
• Weighted residual factors for all reflections included in the refinement: 0.2587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No