Crystallography Open Database

Information card for entry 7705616

Preview

Coordinates	7705616.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H96 F24 N8 P4 Pd2 Si8
Calculated formula	C64 H96 F24 N8 P4 Pd2 Si8
Title of publication	Flexibility and anion exchange of [(X)@Pd<sub>2</sub>L<sub>4</sub>] cages for recognition of size and charge of polyatomic anions.
Authors of publication	Lee, Jeyeong; Lim, Sangwoo; Kim, Dongwon; Jung, Ok-Sang; Lee, Young-A
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	42
Pages of publication	15002 - 15008
a	16.586 ± 0.003 Å
b	19.95 ± 0.004 Å
c	57.908 ± 0.012 Å
α	90°
β	90°
γ	90°
Cell volume	19161 ± 7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	70
Hermann-Mauguin space group symbol	F d d d :2
Hall space group symbol	-F 2uv 2vw
Residual factor for all reflections	0.0996
Residual factor for significantly intense reflections	0.0949
Weighted residual factors for significantly intense reflections	0.2909
Weighted residual factors for all reflections included in the refinement	0.2974
Goodness-of-fit parameter for all reflections included in the refinement	1.131
Diffraction radiation wavelength	0.65 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
258803 (current)	2020-11-06	cif/ Updating files of 7705614, 7705615, 7705616, 7705617, 7705618 Original log message: Adding full bibliography for 7705614--7705618.cif.	7705616.cif
258251	2020-10-08	cif/ Adding structures of 7705614, 7705615, 7705616, 7705617, 7705618 via cif-deposit CGI script.	7705616.cif