Crystallography Open Database





Information card for 7101619

7101618 << 7101619 >> 7101620

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Coordinates

7101619.cif

Structure parameters

Formula - C17 H19 Cl N O P Pd -
Calculated formula - C17 H19 Cl N O P Pd -
Title of publication Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.
Authors of publication Agostinho, Magno; Braunstein, Pierre
Journal of publication Chemical communications (Cambridge, England)
Year of publication 2007
Journal issue 1
Pages of publication 58 - 60
a 8.555 ± 0.0004 Å
b 8.827 ± 0.0005 Å
c 22.628 ± 0.0009 Å
α 82.744 ± 0.004°
β 83.051 ± 0.004°
γ 86.432 ± 0.0016°
Cell volume 1680.7 ± 0.14 Å3
Cell temperature 173 ± 2 K
Ambient diffraction temperature 173 ± 2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group P -1
Hall symmetry space group -P 1
Residual factor for all reflections 0.1357
Residual factor for observed reflections 0.0956
Weighted residual factors for the observed reflections 0.2505
Weighted residual factors for all reflections included in the refinement 0.2694
Goodness-of-fit parameter for observed reflections 1.105
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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