Crystallography Open Database

Information card for entry 7226702

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Structure parameters

Formula	C28 H28 Co N2 O6
Calculated formula	C28 H28 Co N2 O6
SMILES	C(N(C)C)=[O][Co]12(Oc3c(C=[O]1)c1c(cc3)cccc1)([O]=CN(C)C)Oc1c(C=[O]2)c2c(cc1)cccc2
Title of publication	Synthesis, characterization and immobilization of a new cobalt (II) complex on modified magnetic nanoparticles as catalyst for epoxidation of alkenes and oxidation of activated alkanes
Authors of publication	Asgharpour, Zeinab; Farzaneh, Faezeh; Abbasi, Alireza
Journal of publication	RSC Adv.
Year of publication	2016
a	6.246 ± 0.0012 Å
b	9.551 ± 0.0019 Å
c	11.301 ± 0.002 Å
α	97.11 ± 0.03°
β	96.87 ± 0.03°
γ	106.95 ± 0.03°
Cell volume	631.3 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0543
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.0977
Weighted residual factors for all reflections included in the refinement	0.1015
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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
301865 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/22/ Each referenced PubChem compound corresponds to the full crystal structure.	7226702.cif
186897	2016-10-04	cif/ Adding structures of 7226702 via cif-deposit CGI script.	7226702.cif