Crystallography Open Database

Information card for entry 7039025

Preview

Coordinates	7039025.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H11 N O2 Zn
Calculated formula	C8 H11 N O2 Zn
Title of publication	Structural diversity of alkylzinc complexes with pyrrole-based N,O-ligands: from molecular complexes to coordination polymers.
Authors of publication	Wróbel, Zbigniew; Justyniak, Iwona; Dranka, Izabela; Lewiński, Janusz
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	17
Pages of publication	7240 - 7243
a	8.517 ± 0.0006 Å
b	6.232 ± 0.0003 Å
c	8.78 ± 0.0006 Å
α	90°
β	112.358 ± 0.003°
γ	90°
Cell volume	430.99 ± 0.05 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0488
Residual factor for significantly intense reflections	0.0398
Weighted residual factors for significantly intense reflections	0.0847
Weighted residual factors for all reflections included in the refinement	0.0899
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
182749 (current)	2016-05-06	cif/ Updating files of 7039025, 7039026, 7039027 Original log message: Adding full bibliography for 7039025--7039027.cif.	7039025.cif
182135	2016-04-15	cif/ Adding structures of 7039025, 7039026, 7039027 via cif-deposit CGI script.	7039025.cif