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Information card for entry 4309528
Preview
Coordinates | 4309528.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | EISSC02 |
---|---|
Formula | C47 H40 F12 N6 O4 P2 Pt |
Calculated formula | C47 H40 F12 N6 O4 P2 Pt |
SMILES | [Pt]12([n]3c(c4cc(c5ccc(C[n+]6ccccc6)cc5)cc([n]14)c1cccc[n]21)cccc3)C#Cc1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].C(#N)C |
Title of publication | Synthesis, Structure, Characterization, and Photophysical Studies of a New Platinum Terpyridyl-Based Triad with Covalently Linked Donor and Acceptor Groups |
Authors of publication | Soma Chakraborty; Thaddeus J. Wadas; Heidi Hester; Christine Flaschenreim; Russell Schmehl; Richard Eisenberg |
Journal of publication | Inorganic Chemistry |
Year of publication | 2005 |
Journal volume | 44 |
Pages of publication | 6284 - 6293 |
a | 7.0192 ± 0.0005 Å |
b | 16.7279 ± 0.0011 Å |
c | 40.818 ± 0.003 Å |
α | 90° |
β | 92.187 ± 0.001° |
γ | 90° |
Cell volume | 4789.2 ± 0.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0548 |
Residual factor for significantly intense reflections | 0.0487 |
Weighted residual factors for significantly intense reflections | 0.1137 |
Weighted residual factors for all reflections included in the refinement | 0.1165 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.109 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4309528.html
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Users of the data should acknowledge the original authors of the
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