Test Crystallography Open Database

Information card for entry 7700031

Preview

Coordinates	7700031.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H6 N O6 P Zn
Calculated formula	C3 H6 N O6 P Zn
Title of publication	Zinc(ii), cobalt(ii) and manganese(ii) networks with phosphoserine ligand: synthesis, crystal structures and magnetic and proton conductivity properties
Authors of publication	Vallejo, J.; Salcedo, I. R.; Colodrero, R. M. P.; Cabeza, A.; Świtlicka, A.; Cano, J.; Viciano-Chumillas, M.
Journal of publication	Dalton Transactions
Year of publication	2017
Journal volume	46
Journal issue	47
Pages of publication	16570 - 16579
a	5.1818 ± 0.0006 Å
b	7.6909 ± 0.0009 Å
c	17.7166 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	706.05 ± 0.13 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0419
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for significantly intense reflections	0.0635
Weighted residual factors for all reflections included in the refinement	0.0666
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
1152 (current)	2025-07-01	cif/ Adding structures of 7700029, 7700030, 7700031, 7700032 via cif-deposit CGI script.	7700031.cif