Crystallography Open Database

Information card for entry 4322264

Preview

Coordinates	4322264.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H22 F18 In N O3
Calculated formula	C18 H22 F18 In N O3
SMILES	[In](OC(C(F)(F)F)C(F)(F)F)(OC(C(F)(F)F)C(F)(F)F)(OC(C(F)(F)F)C(F)(F)F)[NH]1C(CCCC1(C)C)(C)C
Title of publication	Indium Fluoroalkoxide Compounds
Authors of publication	Liliana A. Mîinea; Seigi Suh; David M. Hoffman
Journal of publication	Inorganic Chemistry
Year of publication	1999
Journal volume	38
Pages of publication	4447 - 4454
a	14.7601 ± 0.001 Å
b	11.3221 ± 0.0008 Å
c	17.8837 ± 0.0012 Å
α	90°
β	112.893 ± 0.001°
γ	90°
Cell volume	2753.2 ± 0.3 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0241
Residual factor for significantly intense reflections	0.0208
Weighted residual factors for significantly intense reflections	0.0513
Weighted residual factors for all reflections included in the refinement	0.0543
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
189895 (current)	2017-01-05	cif/4/32/22/ (antanas@echidna.ibt.lt) Replacing the '=46' prefix with the 'F' prefix in atom names in entries 4322262, 4322263, 4322264.	4322264.cif
179325	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/22.	4322264.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4322264.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4322264.cif
20535	2011-06-11	../uploads/cif-deposit/cod/cif Adding structures of 4322264 via cif-deposit CGI script.	4322264.cif