Crystallography Open Database

Information card for entry 9017774

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Coordinates	9017774.cif

Structure parameters

Formula	Al F5 Mg
Calculated formula	Al F5 Mg
Title of publication	The thermal dehydration of magnesium aluminum pentafluoride dihydrate: crystal structures of MgAlF5(H2O)2 and MgAlF5
Authors of publication	Weil, M.; Werner, F.
Journal of publication	Monatshefte fur Chemie
Year of publication	2001
Journal volume	132
Pages of publication	769 - 777
a	7.268 Å
b	6.123 Å
c	3.543 Å
α	90°
β	90°
γ	90°
Cell volume	157.67 Å³
Number of distinct elements	3
Space group number	71
Hermann-Mauguin space group symbol	I m m m
Hall space group symbol	-I 2 2
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
283960 (current)	2023-05-23	cif/9/ (saulius@tasmanijos-velnias) Estimating atom types and attached hydrogen counts for all range 9 COD entries. Atom types and hydrogen counts for about 170 entries were adjusted manually after running 'cif_guess_AMCSD_atom_types'. Commiting only those entries where declared and calculated summary formulae are matching exactly. To get the reduced formula, the Z value was estimated with 'cif_estimate_Z' after atom type adjustment. NB.: some files still do not contain the Z value, since the Z that was written into the files was estimated before the atom type correction was made, not after. The Z values will be recomputed once more after the atom types are checked in.	9017774.cif
282074	2023-03-27	cod/ (saulius@kukutis) Syncronising the AMCSD and the COD: depositing those AMCSD files that are genuinely new (i.e. do not have corresponding COD entries when compared using DOI, atomic coordinates, cell parameters and symmetry).	9017774.cif