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Information card for entry 7037823
Preview
Coordinates | 7037823.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C60 H40 P2 |
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Calculated formula | C60 H40 P2 |
SMILES | c1(c(ccc2c1cccc2)P(c1cc2c(cc1)cccc2)c1cc2c(cc1)cccc2)c1c(ccc2ccccc12)P(c1cc2c(cc1)cccc2)c1cc2c(cc1)cccc2 |
Title of publication | Synthesis and photocatalytic activity of a naphthyl-substituted photosensitizing BINAP-palladium complex. |
Authors of publication | Son, Changsu; Inagaki, Akiko |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 4 |
Pages of publication | 1331 - 1334 |
a | 19.756 ± 0.011 Å |
b | 10.922 ± 0.006 Å |
c | 10.065 ± 0.005 Å |
α | 90° |
β | 92.043 ± 0.007° |
γ | 90° |
Cell volume | 2170 ± 2 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 3 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0395 |
Residual factor for significantly intense reflections | 0.0383 |
Weighted residual factors for significantly intense reflections | 0.1018 |
Weighted residual factors for all reflections included in the refinement | 0.103 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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