Crystallography Open Database

Information card for entry 9015628

Preview

Coordinates	9015628.cif
External links	AMCSD

Structure parameters

Formula	N S
Calculated formula	H5 N S
SMILES	[NH4+].[SH-]
Title of publication	The Crystal Structures of Some Alkali Hydrosulfides and Monosulfides. _cod_database_code 1010249
Authors of publication	West, C.
Journal of publication	Zeitschrift fur Kristallographie
Year of publication	1934
Journal volume	88
Pages of publication	97 - 115
a	6.011 Å
b	6.011 Å
c	4.009 Å
α	90°
β	90°
γ	90°
Cell volume	144.854 Å³
Number of distinct elements	2
Space group number	129
Hermann-Mauguin space group symbol	P 4/n m m :1
Hall space group symbol	P 4ab 2ab -1ab
Duplicate of	1010249
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
292002 (current)	2024-05-23	Inserting missing Z values into entries of range 9	9015628.cif
201816	2017-10-06	cod/ Enhancement: marking COD entries that are known to be related to the AMCSD entries using the _cod_related_entry data loop.	9015628.cif
188008	2016-11-07	cif/9/01 Marking attached hydrogen atoms for N, O and S atoms.	9015628.cif
184280	2016-07-07	cif/9/ Marking 756 entries in range 9* as duplicates of other entries in the COD. All entries, containing '_cod_database_code' in their titles, were copied to a separate MySQL table 'duplicates' for comparison of the rest of their titles against the "original" entries. Formulae, both given by authors and calculated, were not compared, since duplicate entries in range 9* do not contain Z values. Command to compare and mark the duplicates: mysql -u root duplicates9 -p -e 'select A.file, B.file from data as A join duplicates as B on A.file = B.duplicateof and replace(replace(replace(A.title, "~", ""), " ", ""), "$-", "") = replace(B.title, " ", "") where A.duplicateof is null' -N \ \| while read -a LINE; \ do \ cat $(cod-locate ${LINE[1]}) <(echo _cod_duplicate_entry ${LINE[0]}) \ \| cif_filter -h $(cod-locate ${LINE[1]}) \ \| sponge $(cod-locate ${LINE[1]}); \ done	9015628.cif
176725	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 9.	9015628.cif
86000	2013-05-09	cif/ (saulius@koala.ibt.lt) Adding new mineral structures from AMCSD.	9015628.cif