Crystallography Open Database

Information card for entry 7125947

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Structure parameters

Formula	C336 H240 N48 O48 Pd6
Calculated formula	C336 H240 N48 O48 Pd6
Title of publication	Molecular balloon, Pd<sub>6</sub>L<sub>8</sub> cages: recognition of alkyl sulfate surfactants.
Authors of publication	Lee, Haeri; Kim, Dongwon; Oh, Hyejin; Jung, Ok-Sang
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	19
Pages of publication	2841 - 2844
a	35.325 ± 0.005 Å
b	35.325 ± 0.005 Å
c	49.962 ± 0.01 Å
α	90°
β	90°
γ	90°
Cell volume	62345 ± 18 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.3047
Residual factor for significantly intense reflections	0.1517
Weighted residual factors for significantly intense reflections	0.3986
Weighted residual factors for all reflections included in the refinement	0.4698
Goodness-of-fit parameter for all reflections included in the refinement	0.955
Diffraction radiation wavelength	0.75 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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