Crystallography Open Database

Information card for entry 7706662

Preview

Coordinates	7706662.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H41 N7 O9 Zn
Calculated formula	C30 H34 N6 O8 Zn
Title of publication	Anion and solvent controlled growth of crystalline and amorphous zinc(ii) coordination polymers and a molecular complex.
Authors of publication	Deville, Claire; Jeppesen, Henrik S.; McKee, Vickie; Lock, Nina
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	11
Pages of publication	3979 - 3989
a	13.7729 ± 0.0008 Å
b	13.7729 ± 0.0008 Å
c	19.5804 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	3714.3 ± 0.4 Å³
Cell temperature	250 ± 2 K
Ambient diffraction temperature	250 ± 2 K
Number of distinct elements	5
Space group number	76
Hermann-Mauguin space group symbol	P 41
Hall space group symbol	P 4w
Residual factor for all reflections	0.0448
Residual factor for significantly intense reflections	0.0376
Weighted residual factors for significantly intense reflections	0.1013
Weighted residual factors for all reflections included in the refinement	0.1054
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	0.56086 Å
Diffraction radiation type	AgKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
263765 (current)	2021-04-05	cif/ Updating files of 7706658, 7706659, 7706660, 7706661, 7706662 Original log message: Adding full bibliography for 7706658--7706662.cif.	7706662.cif
262177	2021-02-24	cif/ Adding structures of 7706658, 7706659, 7706660, 7706661, 7706662 via cif-deposit CGI script.	7706662.cif