Crystallography Open Database

Information card for entry 1511428

Preview

Coordinates	1511428.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Na8 (B12 (B Se3)6)
Formula	B18 Na8 Se18
Calculated formula	B18 Na8 Se18
SMILES	B1([Se][B]2345[B]6789[B]%10%11%122[B]2%13%14%15[B]%166%10([B]6%10%177[Se]B([Se][B]7%13%166[B]6%132([B]2%16%177[B]39%10([Se]B([Se]8)[Se-])[B]462([B]5%12%14%13[Se]1)[Se]B([Se]%16)[Se-])[Se]B([Se]%15)[Se-])[Se-])[Se]B([Se]%11)[Se-])[Se-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
Title of publication	Na8 (B12 (B Se3)6): A novel selenoborato-closo-dodecaborate
Authors of publication	Hammerschmidt, A.; Doech, M.; Puetz, S.; Krebs, B.
Journal of publication	Zeitschrift fuer Anorganische und Allgemeine Chemie
Year of publication	2004
Journal volume	630
Pages of publication	2299 - 2303
a	10.9902 Å
b	16.2789 Å
c	11.4889 Å
α	90°
β	117.821°
γ	90°
Cell volume	1817.87 Å³
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	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 1.	1511428.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1511428.cif
84856	2013-05-02	cif/ Adding structures of 1511428 via cif-deposit CGI script.	1511428.cif