Crystallography Open Database

Information card for entry 1505166

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Structure parameters

Formula	C22 H20 N2 O2
Calculated formula	C22 H20 N2 O2
SMILES	c12ccccc1n(c(n2)c1ccccc1OC)Cc1ccccc1OC
Title of publication	Efficient Route for Cyclic Olefin Polymerization: Nonchelated Monodentate Benzimidazole Nickel(II) Complex Catalysts for Vinyl Polymerization of Norbornene
Authors of publication	Tarte, Naresh H.; Cho, Hyun Yong; Woo, Seong Ihl
Journal of publication	Macromolecules
Year of publication	2007
Journal volume	40
Journal issue	23
Pages of publication	8162
a	9.6638 ± 0.0002 Å
b	10.4904 ± 0.0002 Å
c	18.0444 ± 0.0003 Å
α	90°
β	91.062 ± 0.001°
γ	90°
Cell volume	1828.98 ± 0.06 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
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	0.0839
Residual factor for significantly intense reflections	0.0438
Weighted residual factors for significantly intense reflections	0.1103
Weighted residual factors for all reflections included in the refinement	0.1296
Goodness-of-fit parameter for all reflections included in the refinement	1.013
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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