Crystallography Open Database

Information card for entry 7717214

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Coordinates	7717214.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C65 H58 B Cl2 F24 N9 Zn2
Calculated formula	C65 H58 B Cl2 F24 N9 Zn2
Title of publication	An aniline-bridged <i>bis</i>(pyrazolyl)alkane ligand for dizinc-catalysed ring-opening polymerization.
Authors of publication	Naik, Pratyush K.; Gu, Zipeng; Comito, Robert J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	43
Pages of publication	17443 - 17447
a	13.2518 ± 0.0003 Å
b	13.636 ± 0.0003 Å
c	21.3029 ± 0.0004 Å
α	77.125 ± 0.001°
β	76.366 ± 0.001°
γ	85.93 ± 0.001°
Cell volume	3646.25 ± 0.14 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0388
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.097
Weighted residual factors for all reflections included in the refinement	0.0984
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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