Crystallography Open Database

Information card for entry 2023353

2023352 << 2023353 >> 2023354

Preview

Coordinates	2023353.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Diiodidobis(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II)
Formula	C18 H14 I2 N2 O2 Zn
Calculated formula	C18 H14 I2 N2 O2 Zn
Title of publication	Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide
Authors of publication	Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.
Journal of publication	Acta Crystallographica Section E Crystallographic Communications
Year of publication	2025
Journal volume	81
Journal issue	2
a	7.7325 ± 0.0003 Å
b	8.9596 ± 0.0004 Å
c	14.8297 ± 0.0009 Å
α	93.205 ± 0.004°
β	99.873 ± 0.004°
γ	104.852 ± 0.004°
Cell volume	972.98 ± 0.09 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 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	0.0248
Residual factor for significantly intense reflections	0.0201
Weighted residual factors for significantly intense reflections	0.0463
Weighted residual factors for all reflections included in the refinement	0.0481
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
297321 (current)	2025-01-15	cif/ Adding structures of 2023351, 2023352, 2023353, 2023354, 2023355 via cif-deposit CGI script.	2023353.cif