Titanocene dichloride
- Formula: C10H10Cl2Ti
- Molecular weight: 248.959
- IUPAC Standard InChIKey: XKLWATAZDMHTSH-UHFFFAOYSA-L
- CAS Registry Number: 1271-19-8
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Titanium, dichlorobis(η5-2,4-cyclopentadien-1-yl)-; Titanium, dichlorodi-π-cyclopentadienyl-; bis(η5-Cyclopentadienyl)titanium dichloride; Bis(π-cyclopentadienyl)titanium dichloride; Bis(cyclopentadienyl)titanium dichloride; Dichlorobis(π-cyclopentadienyl)titanium; Dichlorobis(cyclopentadienyl)titanium; Dichlorodi-π-cyclopentadienyltitanium; Dichlorodicyclopentadienyltitanium; Dichlorotitanocene; Dicyclopentadienyldichlorotitanium; Dicyclopentadienyltitanium dichloride; Bis(π-cyclopentadienyl)dichlorotitanium; Dichlorobis(η5-cyclopentadienyl)titanium; Dichlorobis(η5-2,4-cyclopentadien-1-yl)titanium; NCI-C04502; Titanium, bis(cyclopentadienyl)dichloride-; Bis(cyclopentadienyl)dichlorotitanium; Dichlorobis(1,3-cyclopentadiene)titanium; NSC 78453; dichlorobis(η-cyclopentadienyl)titanium
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Reaction thermochemistry data
Go To: Top, 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
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Individual Reactions
C10H10I2Ti (solution) + (solution) = 2C10H10ClITi (solution)
By formula: C10H10I2Ti (solution) + C10H10Cl2Ti (solution) = 2C10H10ClITi (solution)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -0.81 | kcal/mol | EqS | Bruce and Tyler, 1985 | solvent: Perdeuterated benzene; The reaction enthalpy relies on a single value for the equilibrium constant. It assumes a negligible reaction entropy |
C30H28Fe2Ti (cr) + 2( • 4.40) (solution) = 2 (cr) + (cr)
By formula: C30H28Fe2Ti (cr) + 2(HCl • 4.40H2O) (solution) = 2C10H10Fe (cr) + C10H10Cl2Ti (cr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -60.6 ± 1.1 | kcal/mol | RSC | Dias, Salema, et al., 1982 | Please also see Calhorda, Dias, et al., 1987. |
C22H20O2Ti (cr) + 2( • 5.55) (solution) = 2 (cr) + (cr)
By formula: C22H20O2Ti (cr) + 2(HCl • 5.55H2O) (solution) = 2C6H6O (cr) + C10H10Cl2Ti (cr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -1.4 ± 0.60 | kcal/mol | RSC | Dias, Salema, et al., 1981 | Please also see Calhorda, Carrondo, et al., 1986. |
C14H10Cl6O4Ti (cr) + 2( • 4.40) (solution) = (cr) + 2 (cr)
By formula: C14H10Cl6O4Ti (cr) + 2(HCl • 4.40H2O) (solution) = C10H10Cl2Ti (cr) + 2C2HCl3O2 (cr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3.20 ± 0.62 | kcal/mol | RSC | Dias, Salema, et al., 1984 | Please also see Calhorda, Carrondo, et al., 1986. |
C10H10N6Ti (cr) + 2( • 4.18) (solution) = (cr) + 2 (g)
By formula: C10H10N6Ti (cr) + 2(HCl • 4.18H2O) (solution) = C10H10Cl2Ti (cr) + 2HN3 (g)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 18.1 ± 1.4 | kcal/mol | RSC | Calhorda, Gomes da Costa, et al., 1982 | Please also see Dias, Dias, et al., 1987. |
C14H10F6O4Ti (cr) + 2( • 4.40) (solution) = (cr) + 2 (l)
By formula: C14H10F6O4Ti (cr) + 2(HCl • 4.40H2O) (solution) = C10H10Cl2Ti (cr) + 2C2HF3O2 (l)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.03 ± 0.55 | kcal/mol | RSC | Calado, Dias, et al., 1981 | Please also see Calhorda, Carrondo, et al., 1986. |
(cr) + 2( • 5.55) (solution) = (cr) + 2 (g)
By formula: C12H16Ti (cr) + 2(HCl • 5.55H2O) (solution) = C10H10Cl2Ti (cr) + 2CH4 (g)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -45.9 ± 1.4 | kcal/mol | RSC | Calhorda, Dias, et al., 1987 |
C11H13ClTi (cr) + ( • 4.40) (solution) = (cr) + (g)
By formula: C11H13ClTi (cr) + (HCl • 4.40H2O) (solution) = C10H10Cl2Ti (cr) + CH4 (g)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -16.5 ± 0.74 | kcal/mol | RSC | Calhorda, Dias, et al., 1987 |
References
Go To: Top, Reaction thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Bruce and Tyler, 1985
Bruce, M.R.M.; Tyler, D.R.,
Organometallics, 1985, 4, 528. [all data]
Dias, Salema, et al., 1982
Dias, A.R.; Salema, M.S.; Martinho Simões, J.A.,
Organometallics, 1982, 1, 971. [all data]
Calhorda, Dias, et al., 1987
Calhorda, M.J.; Dias, A.R.; Minas da Piedade M.E.; Salema, M.S.; Martinho Simões J.A.,
Organometallics, 1987, 6, 734. [all data]
Dias, Salema, et al., 1981
Dias, A.R.; Salema, M.S.; Martinho Simões, J.A.,
J. Organometal. Chem., 1981, 222, 69. [all data]
Calhorda, Carrondo, et al., 1986
Calhorda, M.J.; Carrondo, M.A.A.F.C.T.; Dias, A.R.; Domingos, A.M.T.S.; Martinho Simões, J.A.; Teixeira, C.,
Organometallics, 1986, 5, 660. [all data]
Dias, Salema, et al., 1984
Dias, A.R.; Salema, M.S.; Martinho Simões, J.A.,
Rev. Port. Quím., 1984, 26, 227. [all data]
Calhorda, Gomes da Costa, et al., 1982
Calhorda, M.J.; Gomes da Costa, R.; Dias, A.R.; Martinho Simões, J.A.,
J. Chem. Soc., Dalton Trans., 1982, 2327.. [all data]
Dias, Dias, et al., 1987
Dias, A.R.; Dias, P.B.; Diogo, H.P.; Galvão, A.M.; Minas da Piedade, M.E.; Martinho Simões, J.A.,
Organometallics, 1987, 6, 1427. [all data]
Calado, Dias, et al., 1981
Calado, J.C.G.; Dias, A.R.; Salema, M.S.; Martinho Simões, J.A.,
J. Chem. Soc., Dalton Trans., 1981, 1174.. [all data]
Notes
Go To: Top, Reaction thermochemistry data, References
- Symbols used in this document:
ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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