Crystallography Open Database

Information card for entry 4129957

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Coordinates	4129957.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C61.5 H68 Cl11.5 N4 O8 Pd2
Calculated formula	C61.5 H68 Cl11.4999 N4 O8 Pd2
Title of publication	Photo- and Metallo-responsive N-Alkyl α-Bisimines as Orthogonally Addressable Main-Chain Functional Groups in Metathesis Polymers.
Authors of publication	Greb, Lutz; Mutlu, Hatice; Barner-Kowollik, Christopher; Lehn, Jean-Marie
Journal of publication	Journal of the American Chemical Society
Year of publication	2016
Journal volume	138
Journal issue	4
Pages of publication	1142 - 1145
a	12.1685 ± 0.0014 Å
b	29.393 ± 0.004 Å
c	22.13 ± 0.003 Å
α	90°
β	93.436 ± 0.011°
γ	90°
Cell volume	7901 ± 1.8 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	6
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	0.1089
Residual factor for significantly intense reflections	0.0734
Weighted residual factors for significantly intense reflections	0.2061
Weighted residual factors for all reflections included in the refinement	0.232
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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