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Information card for entry 4347653
Preview
Coordinates | 4347653.cif |
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Original paper (by DOI) | HTML |
Formula | C56 H52 Cl4 N4 Zn |
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Calculated formula | C56 H50 Cl4 N4 Zn |
SMILES | [Zn]12([n]3c(C)cc(c3=C(c3n1c(C)cc3C)c1c3c(cc4c1cccc4)cccc3)C)[n]1c(=C(c3c4ccccc4cc4ccccc34)c3n2c(C)cc3C)c(C)cc1C.ClCCl.ClCCl |
Title of publication | Bis(dipyrrinato)zinc(II) Complexes: Emission in the Solid State. |
Authors of publication | Tsuchiya, Mizuho; Sakamoto, Ryota; Shimada, Masaki; Yamanoi, Yoshinori; Hattori, Yohei; Sugimoto, Kunihisa; Nishibori, Eiji; Nishihara, Hiroshi |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 12 |
Pages of publication | 5732 - 5734 |
a | 25.18 ± 0.01 Å |
b | 20.397 ± 0.008 Å |
c | 18.983 ± 0.007 Å |
α | 90° |
β | 98.106 ± 0.005° |
γ | 90° |
Cell volume | 9652 ± 6 Å3 |
Cell temperature | 113 K |
Ambient diffraction temperature | 113 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for significantly intense reflections | 0.0696 |
Weighted residual factors for all reflections included in the refinement | 0.2237 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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