Titanium, trichlorocyclopentadienyl-
- Formula: C5H5Cl3Ti
- Molecular weight: 219.319
- IUPAC Standard InChIKey: AENCLWKVWIIOQH-UHFFFAOYSA-K
- CAS Registry Number: 1270-98-0
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: η5-Cyclopentadienyltitanium trichloride; Cyclopentadienyltitanium trichloride; π-Cyclopentadienyltitanium trichloride; Cyclopentadiene titanium trichloride; Cyclopentadienyltrichlorotitanium; Titanium, trichloro(η5-2,4-cyclopentadien-1-yl)-; Titanium, trichloro-π-cyclopentadienyl-; Trichloro(cyclopentadienyl)titanium; Trichloro-π-cyclopentadienyltitanium; Cyclopentadienyltitanium(IV) trichloride; Trichloro(cyclopentyldienyl)titanium
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Gas phase thermochemistry data
Go To: Top, Condensed phase thermochemistry data, Gas phase ion energetics data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: José A. Martinho Simões
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | -520.8 ± 6.8 | kJ/mol | Review | Martinho Simões |
Condensed phase thermochemistry data
Go To: Top, Gas phase thermochemistry data, Gas phase ion energetics data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: José A. Martinho Simões
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°solid | -609.9 ± 6.8 | kJ/mol | Review | Martinho Simões | |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -3087.0 ± 6.7 | kJ/mol | CC-SB | Tel' noi, Rabinovich, et al., 1967 | Please also see Pedley and Rylance, 1977 and Tel'noi and Rabinovich, 1977. The enthalpy of combustion was quoted from Tel'noi and Rabinovich, 1977 |
Gas phase ion energetics data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
9.1 | PE | Terpstra, Louwen, et al., 1984 | LBLHLM |
9.79 | PE | Terpstra, Louwen, et al., 1984 | Vertical value; LBLHLM |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Martinho Simões
Martinho Simões, J.A.,
Private communication (see http://webbook.nist.gov/chemistry/om/). [all data]
Tel' noi, Rabinovich, et al., 1967
Tel' noi, V.I.; Rabinovich, I.B.; Tikhonov, V.D.; Latyaeva, V.N.; Vyshmskaya, L.I.; Razuvaev, G.A.,
Dokl. Akad. Nauk SSSR, 1967, 174, 1374. [all data]
Pedley and Rylance, 1977
Pedley, J.B.; Rylance, J.,
Computer Analysed Thermochemical Data: Organic and Organometallic Compounds, University of Sussex, Brigton, 1977. [all data]
Tel'noi and Rabinovich, 1977
Tel'noi, V.I.; Rabinovich, I.B.,
Russ. Chem. Rev., 1977, 46, 689. [all data]
Terpstra, Louwen, et al., 1984
Terpstra, A.; Louwen, J.N.; Oskam, A.; Teuben, J.H.,
The He(I) and He(II) photoelectron spectra of some η5-cyclopentadienyl-titanium,-zirconium and -hafnium trihalide complexes,
J. Organomet. Chem., 1984, 260, 207. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Gas phase ion energetics data, References
- Symbols used in this document:
ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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