Crystallography Open Database

Information card for entry 9011444

Preview

Coordinates	9011444.cif
Original paper (by DOI)	HTML
External links	AMCSD

Structure parameters

Mineral name	Tschermigite
Formula	Al H28 N O20 S2
Calculated formula	Al H28 N O20 S2
Title of publication	X-ray and neutron diffraction study of alums II. The crystal structure of methylammonium aluminium alum III. The crystal structure of ammonium aluminium alum Locality: synthetic Sample: X-ray data
Authors of publication	Abdeen, A. M.; Will, G.; Schaefer, W.; Kirfel, A.; Bargouth, M. O.; Recker, K.; Weiss, A.
Journal of publication	Zeitschrift fur Kristallographie
Year of publication	1981
Journal volume	157
Journal issue	3-4
Pages of publication	147 - 166
a	12.242 Å
b	12.242 Å
c	12.242 Å
α	90°
β	90°
γ	90°
Cell volume	1834.67 Å³
Number of distinct elements	5
Space group number	205
Hermann-Mauguin space group symbol	P a -3
Hall space group symbol	-P 2ac 2ab 3
Diffraction radiation probe	x-ray
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
282478 (current)	2023-04-06	cif/ Marked entries as being related to AMCSD using the COD_RELATED_ENTRY loop.	9011444.cif
190548	2017-01-15	cif/9/ (antanas@kurmis) Adding the _database_code_amcsd data item in entries 9008299, 9011444.	9011444.cif
190546	2017-01-15	cif/9/ (antanas@kurmis) Correcting the _chemical_formula_sum data item values in entries 9011443, 9011444, 9014484 after consulting the original publication.	9011444.cif
190545	2017-01-15	cif/9/ (antanas@kurmis) Marking attached hydrogen atoms in entries 9011443, 9011444, 9014484.	9011444.cif
190542	2017-01-15	cif/9/ (antanas@kurmis) Correcting the _chemical_formula_sum data item values in entries 9011444, 9014484, 9015540.	9011444.cif
190541	2017-01-15	cif/9/01/14 (antanas@kurmis) Changing the _atom_site_label data item values to match the _atom_site_aniso_label data item values after consulting the original publication in entry 9011444.	9011444.cif
190540	2017-01-15	cif/9/ (antanas@kurmis) Adding the _diffrn_radiation_probe data item in entries 9008299, 9011444, 9014484, 9015540.	9011444.cif
190539	2017-01-15	cif/9/ (antanas@kurmis) Adding the _cell_formula_units_Z data item in entries 9008299, 9011444, 9014484, 9015540.	9011444.cif
190538	2017-01-15	cif/9/ (antanas@kurmis) Adding the _atom_site_type_symbol data item in entries 9008299, 9011444, 9014484, 9015540.	9011444.cif
190537	2017-01-15	cif/9/ (antanas@kurmis) Updating bibliography in entries 9008299, 9011442, 9011443, 9011444, 9014484, 9015540.	9011444.cif
176465	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 9.	9011444.cif
85285	2013-05-05	cod/ (saulius@koala.ibt.lt) Removing outdated _amcsd_database_code data items from all series 9 CIFs.	9011444.cif
35913	2012-02-28	cif/9/ Reorganising range 9 into a prefix-directory tree. Range 9 is the last range to be reorganised.	9011444.cif
1210	2010-06-10	cif/9/ Updating 13213 AMCSD CIFs, taking new data from the AMCSD database and adding the assigned AMCSD numbers.	9011444.cif
1071	2010-04-10	cif/9/ Updating COD entries from AMCSD, processed in the AMCSD-resynchronisation-2009.06.24/ directory. Entries are updated if they could be unambiguously mapped to a unique COD number by automatic search scripts in AMCSD-resynchronisation-2009.06.24/.	9011444.cif
966	2010-01-30	cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated.	9011444.cif
903	2009-11-23	cif/ Setting svn:keywords property on those CIFs that did not have them.	9011444.cif
649	2009-04-18	Depositing new CIFs from AMCSD-resynchronisation-2009.03.27/.	9011444.cif