Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]

The reaction of neodymium nitrate and 4-tert-butylbenzoic acid (tBBAH) in aqueous solution yielded the dinuclear title complex, [Nd2(C11H13O2)6(C11H14O2)2(H2O)2], which has non-crystallographic Ci symmetry. The two NdIII ions are linked by two bridging and two bridging–chelating tBBA l...

Full description

Bibliographic Details
Main Authors: Juan Yang, Jun Dai
Format: Article
Language:English
Published: International Union of Crystallography 2011-06-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811015194
_version_ 1819290594172731392
author Juan Yang
Jun Dai
author_facet Juan Yang
Jun Dai
author_sort Juan Yang
collection DOAJ
description The reaction of neodymium nitrate and 4-tert-butylbenzoic acid (tBBAH) in aqueous solution yielded the dinuclear title complex, [Nd2(C11H13O2)6(C11H14O2)2(H2O)2], which has non-crystallographic Ci symmetry. The two NdIII ions are linked by two bridging and two bridging–chelating tBBA ligands with an Nd...Nd separation of 4.0624 (5) Å. Moreover, each NdIII ion is coordinated by one chelating tBBA ion, one monodentate tBBAH ligand and one water molecule. The nine-coordinated NdIII ion is in a distorted tricapped trigonal–prismatic environment. The molecules are linked into infinite chains along the c axis by intermolecular O—H...O hydrogen bonds. Three of the tert-butyl groups are disordered over two sets of sites with equal occupancies.
first_indexed 2024-12-24T03:25:13Z
format Article
id doaj.art-3679c1fc4b0942529ed2ab4ec7ddb193
institution Directory Open Access Journal
issn 1600-5368
language English
last_indexed 2024-12-24T03:25:13Z
publishDate 2011-06-01
publisher International Union of Crystallography
record_format Article
series Acta Crystallographica Section E
spelling doaj.art-3679c1fc4b0942529ed2ab4ec7ddb1932022-12-21T17:17:21ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-06-01676m666m66710.1107/S1600536811015194Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]Juan YangJun DaiThe reaction of neodymium nitrate and 4-tert-butylbenzoic acid (tBBAH) in aqueous solution yielded the dinuclear title complex, [Nd2(C11H13O2)6(C11H14O2)2(H2O)2], which has non-crystallographic Ci symmetry. The two NdIII ions are linked by two bridging and two bridging–chelating tBBA ligands with an Nd...Nd separation of 4.0624 (5) Å. Moreover, each NdIII ion is coordinated by one chelating tBBA ion, one monodentate tBBAH ligand and one water molecule. The nine-coordinated NdIII ion is in a distorted tricapped trigonal–prismatic environment. The molecules are linked into infinite chains along the c axis by intermolecular O—H...O hydrogen bonds. Three of the tert-butyl groups are disordered over two sets of sites with equal occupancies.http://scripts.iucr.org/cgi-bin/paper?S1600536811015194
spellingShingle Juan Yang
Jun Dai
Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]
Acta Crystallographica Section E
title Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]
title_full Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]
title_fullStr Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]
title_full_unstemmed Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]
title_short Tetrakis(μ-4-tert-butylbenzoato)-κ4O:O′;κ3O,O′:O′;κ3O:O,O′-bis[aqua(4-tert-butylbenzoato-κ2O,O′)(4-tert-butylbenzoic acid-κO)neodymium(III)]
title_sort tetrakis amp 956 4 tert butylbenzoato amp 954 4o o amp 8242 amp 954 3o o amp 8242 o amp 8242 amp 954 3o o o amp 8242 bis aqua 4 tert butylbenzoato amp 954 2o o amp 8242 4 tert butylbenzoic acid amp 954 o neodymium iii
url http://scripts.iucr.org/cgi-bin/paper?S1600536811015194
work_keys_str_mv AT juanyang tetrakisamp9564tertbutylbenzoatoamp9544ooamp8242amp9543ooamp8242oamp8242amp9543oooamp8242bisaqua4tertbutylbenzoatoamp9542ooamp82424tertbutylbenzoicacidamp954oneodymiumiii
AT jundai tetrakisamp9564tertbutylbenzoatoamp9544ooamp8242amp9543ooamp8242oamp8242amp9543oooamp8242bisaqua4tertbutylbenzoatoamp9542ooamp82424tertbutylbenzoicacidamp954oneodymiumiii