Crystallography Open Database

Information card for entry 1556659

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Structure parameters

Formula	C24 H52 Cl Cr Li2 O6
Calculated formula	C24 H52 Cl Cr Li2 O6
SMILES	[O]1([Cr]([O]([Li]1[O]1CCCC1)C(C)(C)C)([O]1C(C)(C)C)[O]([Li]1[O]1CCCC1)C(C)(C)C)C(C)(C)C.[Cl-]
Title of publication	Molecularly Engineered Lithium-Chromium Alkoxide for Selective Synthesis of LiCrO2 and Li2CrO4 Nanomaterials
Authors of publication	Ojelere, O.; Graf, D.; Mathur, S.
Journal of publication	Inorganics
Year of publication	2019
Journal volume	7
Pages of publication	22
a	25.681 ± 0.003 Å
b	8.9889 ± 0.0009 Å
c	18.4468 ± 0.0018 Å
α	90°
β	133.511 ± 0.006°
γ	90°
Cell volume	3088.3 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1314
Residual factor for significantly intense reflections	0.0462
Weighted residual factors for significantly intense reflections	0.0854
Weighted residual factors for all reflections included in the refinement	0.1054
Goodness-of-fit parameter for all reflections included in the refinement	0.778
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
301780 (current)	2025-08-19	Add cross-references to PubChem compounds in COD range 1/55 Each referenced PubChem compound corresponds to the full crystal structure.	1556659.cif
245379	2019-12-19	cif/ Adding structures of 1556659 via cif-deposit CGI script.	1556659.cif