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Information card for entry 1550026
Preview
Coordinates | 1550026.cif |
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Original paper (by DOI) | HTML |
Formula | C58.12 H52.25 Cl0.25 F6 Ir N8 P |
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Calculated formula | C58.125 H52.25 Cl0.25 F6 Ir N8 P |
Title of publication | Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions |
Authors of publication | Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming |
Journal of publication | Chemical Science |
Year of publication | 2018 |
a | 12.7322 ± 0.0006 Å |
b | 16.8417 ± 0.001 Å |
c | 26.2843 ± 0.0012 Å |
α | 77.893 ± 0.003° |
β | 84.194 ± 0.002° |
γ | 78.728 ± 0.003° |
Cell volume | 5393.9 ± 0.5 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 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 | 0.0863 |
Residual factor for significantly intense reflections | 0.0559 |
Weighted residual factors for significantly intense reflections | 0.1395 |
Weighted residual factors for all reflections included in the refinement | 0.1526 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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211369 (current) | 2018-10-11 | cif/ Adding structures of 1550023, 1550024, 1550025, 1550026 via cif-deposit CGI script. |
1550026.cif |
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