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Information card for entry 4070602
Preview
Coordinates | 4070602.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H35 B Cl5 N6 P Pt S3 |
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Calculated formula | C32 H35 B Cl5 N6 P Pt S3 |
Title of publication | Retention of Pt→B Bonding in Oxidative Addition Reactions of the Platinaboratrane [Pt(PPh3){B(mt)3}](Pt→B)10(mt = Methimazolyl) |
Authors of publication | Crossley, Ian R.; Hill, Anthony F.; Willis, Anthony C. |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 3 |
Pages of publication | 312 |
a | 9.7438 ± 0.0002 Å |
b | 12.9979 ± 0.0002 Å |
c | 17.1896 ± 0.0003 Å |
α | 109.965 ± 0.0009° |
β | 101.305 ± 0.0013° |
γ | 93.5646 ± 0.0011° |
Cell volume | 1986.73 ± 0.06 Å3 |
Cell temperature | 200 K |
Ambient diffraction temperature | 200 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0374 |
Residual factor for significantly intense reflections | 0.0261 |
Weighted residual factors for all reflections | 0.0373 |
Weighted residual factors for significantly intense reflections | 0.0276 |
Weighted residual factors for all reflections included in the refinement | 0.0276 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1226 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4070602.cif |
130086 | 2015-01-23 | cod/ (robertas@burundukas) The 'cif_fix_values' program was applied to CIFs that have generated the validation messages containing tag '_exptl_crystal_density_meas'. 16946 CIFs had a values that were perceived as 'not measured' and they were changed to '?'. The total of 17089 CIFs was changed. Those that were not corrected by 'cif_fix_values' were reformatted by the parser (e.g. a doi tag was moved to another place). The processing command was: mysql -u cod_reader -h www.crystallography.net cod -e \ 'select distinct codid from validation \ where message like \ "%tag%_exptl_crystal_density_meas'\''%"' -NB \ | xargs -i sh -c 'cif_fix_values {} \ | cif_filter --add-cif-header {} \ | sponge {}' |
4070602.cif |
120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4070602.cif |
47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070602.cif |
42586 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4070602 via cif-deposit CGI script. |
4070602.cif |
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Users of the data should acknowledge the original authors of the
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