Crystallography Open Database

Information card for entry 7719329

7719328 << 7719329 >> 7719330

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Coordinates	7719329.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C86 H63 B4 F16 N11 Pd2
Calculated formula	C86 H63 B4 F16 N11 Pd2
Title of publication	Multi-dimensional microenvironment engineering in heteroleptic coordination cages for programmable biomimetic recognition.
Authors of publication	Xie, Xiao-Dan; Bai, Qixia; Zhang, Zhe; Wang, Pingshan; Zhang, Qi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	36
Pages of publication	13783 - 13788
a	27.0908 ± 0.0009 Å
b	31.4365 ± 0.0012 Å
c	37.7374 ± 0.0014 Å
α	90°
β	105.463 ± 0.002°
γ	90°
Cell volume	30975 ± 2 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1196
Residual factor for significantly intense reflections	0.0914
Weighted residual factors for significantly intense reflections	0.2658
Weighted residual factors for all reflections included in the refinement	0.2895
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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