Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)

Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)

The molecule of the title organometallic hafnium(IV) compound, [Hf(CH3)3(C13H21)] or [HfMe3(η5-C5H3-1,3-tBu2)], adopts the classical three-legged piano-stool geometry for monocyclopentadienylhafnium(IV) derivatives with the three methyl groups bonded to the Hf(IV) atom at the legs. The C atoms of th...

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Main Authors: Adrián Pérez-Redondo, Víctor Varela-Izquierdo, Carlos Yélamos
Format: Article
Language:English
Published: International Union of Crystallography 2015-05-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
hafnium
cyclopentadienyl ligand
organometallic compound
Online Access:http://scripts.iucr.org/cgi-bin/paper?S205698901500585X
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spelling doaj-c6f814d6765d4038835094e554dbf9c02020-11-24T21:13:46ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902015-05-01715m100m10110.1107/S205698901500585Xwm5139Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)Adrián Pérez-Redondo0Víctor Varela-Izquierdo1Carlos Yélamos2Departamento de Química Orgánica y Química Inorgánica, Universidad de Alcalá, Campus Universitario, ES 28871 Alcalá de Henares (Madrid), SpainDepartamento de Química Orgánica y Química Inorgánica, Universidad de Alcalá, Campus Universitario, ES 28871 Alcalá de Henares (Madrid), SpainDepartamento de Química Orgánica y Química Inorgánica, Universidad de Alcalá, Campus Universitario, ES 28871 Alcalá de Henares (Madrid), SpainThe molecule of the title organometallic hafnium(IV) compound, [Hf(CH3)3(C13H21)] or [HfMe3(η5-C5H3-1,3-tBu2)], adopts the classical three-legged piano-stool geometry for monocyclopentadienylhafnium(IV) derivatives with the three methyl groups bonded to the Hf(IV) atom at the legs. The C atoms of the two tert-butyl group bonded to the cyclopentadienyl (Cp) ring are 0.132 (5) and 0.154 (6) Å above the Cp least-squares plane. There are no significant intermolecular interactions present between the molecules in the crystal structure.http://scripts.iucr.org/cgi-bin/paper?S205698901500585Xcrystal structurehafniumcyclopentadienyl ligandorganometallic compound
collection DOAJ
language English
format Article
sources DOAJ
author Adrián Pérez-Redondo
Víctor Varela-Izquierdo
Carlos Yélamos
spellingShingle Adrián Pérez-Redondo
Víctor Varela-Izquierdo
Carlos Yélamos
Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)
Acta Crystallographica Section E: Crystallographic Communications
crystal structure
hafnium
cyclopentadienyl ligand
organometallic compound
author_facet Adrián Pérez-Redondo
Víctor Varela-Izquierdo
Carlos Yélamos
author_sort Adrián Pérez-Redondo
title Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)
title_short Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)
title_full Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)
title_fullStr Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)
title_full_unstemmed Crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(IV)
title_sort crystal structure of (1,3-di-tert-butyl-η5-cyclopentadienyl)trimethylhafnium(iv)
publisher International Union of Crystallography
series Acta Crystallographica Section E: Crystallographic Communications
issn 2056-9890
publishDate 2015-05-01
description The molecule of the title organometallic hafnium(IV) compound, [Hf(CH3)3(C13H21)] or [HfMe3(η5-C5H3-1,3-tBu2)], adopts the classical three-legged piano-stool geometry for monocyclopentadienylhafnium(IV) derivatives with the three methyl groups bonded to the Hf(IV) atom at the legs. The C atoms of the two tert-butyl group bonded to the cyclopentadienyl (Cp) ring are 0.132 (5) and 0.154 (6) Å above the Cp least-squares plane. There are no significant intermolecular interactions present between the molecules in the crystal structure.
topic crystal structure
hafnium
cyclopentadienyl ligand
organometallic compound
url http://scripts.iucr.org/cgi-bin/paper?S205698901500585X
work_keys_str_mv AT adrianperezredondo crystalstructureof13ditertbutylē5cyclopentadienyltrimethylhafniumiv
AT victorvarelaizquierdo crystalstructureof13ditertbutylē5cyclopentadienyltrimethylhafniumiv
AT carlosyelamos crystalstructureof13ditertbutylē5cyclopentadienyltrimethylhafniumiv
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