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Information card for entry 4083733
Preview
Coordinates | 4083733.cif |
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Original paper (by DOI) | HTML |
Common name | Ir-pdt-bpmc-Er-TTA |
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Formula | C52.5 H41 Br Cl7 Er F9 Ir N8 O8 S3 |
Calculated formula | C52.5 H41 Br Cl7 Er F9 Ir N8 O8 S3 |
Title of publication | Sensitized Near-Infrared Emission from IrIII-LnIII(Ln = Nd, Yb, Er) Bimetallic Complexes with a (N∧O)(N∧O) Bridging Ligand |
Authors of publication | Chen, Fang-Fang; Wei, Hui-Bo; Bian, Zu-Qiang; Liu, Zhi-Wei; Ma, En; Chen, Zhong-Ning; Huang, Chun-Hui |
Journal of publication | Organometallics |
Year of publication | 2014 |
Pages of publication | 140625135042003 |
a | 12.981 ± 0.003 Å |
b | 13.145 ± 0.003 Å |
c | 20.319 ± 0.004 Å |
α | 105.13 ± 0.03° |
β | 90.93 ± 0.03° |
γ | 90.59 ± 0.03° |
Cell volume | 3346.1 ± 1.4 Å3 |
Cell temperature | 113 ± 2 K |
Ambient diffraction temperature | 113 ± 2 K |
Number of distinct elements | 10 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0634 |
Residual factor for significantly intense reflections | 0.0535 |
Weighted residual factors for significantly intense reflections | 0.1383 |
Weighted residual factors for all reflections included in the refinement | 0.1476 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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