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Information card for entry 7043467
Preview
Coordinates | 7043467.cif |
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Original paper (by DOI) | HTML |
Formula | C34 H38 N2 O4 Zn2 |
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Calculated formula | C34 H38 N2 O4 Zn2 |
SMILES | C(C)[Zn]12[O](C(=C(c3cccc[n]13)C)c1ccc(cc1)OC)[Zn]1(CC)[n]3c(C(=C([O]21)c1ccc(OC)cc1)C)cccc3 |
Title of publication | β-Pyridylenolate zinc catalysts for the ring-opening homo- and copolymerization of ε-caprolactone and lactides |
Authors of publication | Bai, Jianliang; Xiao, Xia; Zhang, Yue; Chao, Jianbin; Chen, Xia |
Journal of publication | Dalton Trans. |
Year of publication | 2017 |
a | 8.4891 ± 0.0009 Å |
b | 9.3386 ± 0.0011 Å |
c | 10.7644 ± 0.0013 Å |
α | 77.632 ± 0.003° |
β | 73.281 ± 0.004° |
γ | 87.149 ± 0.003° |
Cell volume | 798.26 ± 0.16 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0975 |
Residual factor for significantly intense reflections | 0.0539 |
Weighted residual factors for significantly intense reflections | 0.1172 |
Weighted residual factors for all reflections included in the refinement | 0.1342 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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