Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I)
The crystal structure of the title compound, [AuCl(C16H13PS)], is reported. The molecular structure features a nearly linear arrangement of the chloride and phosphino ligands around the gold(I) center, with a P—Au—Cl bond angle of 179.42 (9)°. The Au—P and Au—Cl bond lengths are 2.226 (2) and 2.287 ...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2022-10-01
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| Series: | Acta Crystallographica Section E: Crystallographic Communications |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2056989022009227 |
| _version_ | 1811196440294195200 |
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| author | Thomas Neils Andrew LaDuca John E. Bender Richard J. Staples Shannon M. Biros |
| author_facet | Thomas Neils Andrew LaDuca John E. Bender Richard J. Staples Shannon M. Biros |
| author_sort | Thomas Neils |
| collection | DOAJ |
| description | The crystal structure of the title compound, [AuCl(C16H13PS)], is reported. The molecular structure features a nearly linear arrangement of the chloride and phosphino ligands around the gold(I) center, with a P—Au—Cl bond angle of 179.42 (9)°. The Au—P and Au—Cl bond lengths are 2.226 (2) and 2.287 (2) Å, respectively. The geometry of the groups bonded to the phosphorus atom of the ligand is a slightly distorted tetrahedron. The phenyl and thienyl rings of the ligand are extensively disordered, with the thienyl refined over all three possible positions on the phosphorus atom. The relative occupancy ratio between these positions was found to be 0.406 (3):0.406 (2):0.188 (2). One of the major thienyl ring positions with the relative occupancy of 0.406 was modeled as two rotational isomers around the C—P bond with a relative occupancy ratio of 0.278 (3):0.128 (3). Intermolecular C—H...π interactions present in the crystal lattice link molecules of the title compound together to form a complex three-dimensional network. |
| first_indexed | 2024-04-12T00:57:49Z |
| format | Article |
| id | doaj.art-54d9a832701e4c8bb920a00fc9eda752 |
| institution | Directory Open Access Journal |
| issn | 2056-9890 |
| language | English |
| last_indexed | 2024-04-12T00:57:49Z |
| publishDate | 2022-10-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E: Crystallographic Communications |
| spelling | doaj.art-54d9a832701e4c8bb920a00fc9eda7522022-12-22T03:54:33ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902022-10-0178101044104710.1107/S2056989022009227zl5036Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I)Thomas Neils0Andrew LaDuca1John E. Bender2Richard J. Staples3Shannon M. Biros4Department of Chemistry, Grand Valley State University, Allendale, MI 49401, USADepartment of Chemistry, Grand Valley State University, Allendale, MI 49401, USADepartment of Chemistry, Grand Valley State University, Allendale, MI 49401, USACenter for Crystallographic Research, Department of Chemistry, Michigan State University, East Lansing, MI 48824, USADepartment of Chemistry, Grand Valley State University, Allendale, MI 49401, USAThe crystal structure of the title compound, [AuCl(C16H13PS)], is reported. The molecular structure features a nearly linear arrangement of the chloride and phosphino ligands around the gold(I) center, with a P—Au—Cl bond angle of 179.42 (9)°. The Au—P and Au—Cl bond lengths are 2.226 (2) and 2.287 (2) Å, respectively. The geometry of the groups bonded to the phosphorus atom of the ligand is a slightly distorted tetrahedron. The phenyl and thienyl rings of the ligand are extensively disordered, with the thienyl refined over all three possible positions on the phosphorus atom. The relative occupancy ratio between these positions was found to be 0.406 (3):0.406 (2):0.188 (2). One of the major thienyl ring positions with the relative occupancy of 0.406 was modeled as two rotational isomers around the C—P bond with a relative occupancy ratio of 0.278 (3):0.128 (3). Intermolecular C—H...π interactions present in the crystal lattice link molecules of the title compound together to form a complex three-dimensional network.http://scripts.iucr.org/cgi-bin/paper?S2056989022009227crystal structuregold complextriaryl phosphine ligandc—h...π interactiondisorder |
| spellingShingle | Thomas Neils Andrew LaDuca John E. Bender Richard J. Staples Shannon M. Biros Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I) Acta Crystallographica Section E: Crystallographic Communications crystal structure gold complex triaryl phosphine ligand c—h...π interaction disorder |
| title | Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I) |
| title_full | Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I) |
| title_fullStr | Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I) |
| title_full_unstemmed | Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I) |
| title_short | Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κP]gold(I) |
| title_sort | crystal structure of chlorido diphenyl thiophen 2 yl phosphine κp gold i |
| topic | crystal structure gold complex triaryl phosphine ligand c—h...π interaction disorder |
| url | http://scripts.iucr.org/cgi-bin/paper?S2056989022009227 |
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