Crystallography Open Database

Information card for entry 7247220

Preview

Coordinates	7247220.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H88 Cl4 N4 O9 Zn2
Calculated formula	C88 H88 Cl4 N4 O9 Zn2
Title of publication	Single crystals of cyclodimeric zinc(ii) complexes containing 9,10-bis((isoquinolin-5-yloxy)methyl)anthracene: reversible adsorption of target molecules and recognition of CH2I2 in an SCSC mode
Authors of publication	Kim, Gyeongwoo; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	36
Pages of publication	5077 - 5084
a	11.135 ± 0.002 Å
b	19.665 ± 0.004 Å
c	21.122 ± 0.004 Å
α	106.71 ± 0.03°
β	102.08 ± 0.03°
γ	104.65 ± 0.03°
Cell volume	4082 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1295
Residual factor for significantly intense reflections	0.0669
Weighted residual factors for significantly intense reflections	0.2005
Weighted residual factors for all reflections included in the refinement	0.2321
Goodness-of-fit parameter for all reflections included in the refinement	0.871
Diffraction radiation wavelength	0.74 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
286731 (current)	2023-10-06	cif/ Updating files of 7247220, 7247221, 7247222, 7247223 Original log message: Adding full bibliography for 7247220--7247223.cif.	7247220.cif
285807	2023-08-18	cif/ Adding structures of 7247220, 7247221, 7247222, 7247223 via cif-deposit CGI script.	7247220.cif