titanium tetraiodide
- Formula: I4Ti
- Molecular weight: 555.485
- CAS Registry Number: 7720-83-4
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Gas phase thermochemistry 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.
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | -66.269 | kcal/mol | Review | Chase, 1998 | Data last reviewed in December, 1968 |
Quantity | Value | Units | Method | Reference | Comment |
S°gas,1 bar | 103.51 | cal/mol*K | Review | Chase, 1998 | Data last reviewed in December, 1968 |
Gas Phase Heat Capacity (Shomate Equation)
Cp° = A + B*t + C*t2 + D*t3 +
E/t2
H° − H°298.15= A*t + B*t2/2 +
C*t3/3 + D*t4/4 − E/t + F − H
S° = A*ln(t) + B*t + C*t2/2 + D*t3/3 −
E/(2*t2) + G
Cp = heat capacity (cal/mol*K)
H° = standard enthalpy (kcal/mol)
S° = standard entropy (cal/mol*K)
t = temperature (K) / 1000.
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Temperature (K) | 1500. to 6000. |
---|---|
A | 25.80860 |
B | 0.021340 |
C | -0.005796 |
D | 0.000495 |
E | -0.080159 |
F | -74.23480 |
G | 134.2810 |
H | -66.27010 |
Reference | Chase, 1998 |
Comment | Data last reviewed in December, 1968 |
Condensed phase thermochemistry 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.
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°liquid | -83.248 | kcal/mol | Review | Chase, 1998 | Data last reviewed in December, 1968 |
Quantity | Value | Units | Method | Reference | Comment |
S°liquid,1 bar | 74.532 | cal/mol*K | Review | Chase, 1998 | Data last reviewed in December, 1968 |
Quantity | Value | Units | Method | Reference | Comment |
ΔfH°solid | -89.799 | kcal/mol | Review | Chase, 1998 | Data last reviewed in December, 1968 |
Quantity | Value | Units | Method | Reference | Comment |
S°solid | 58.831 | cal/mol*K | Review | Chase, 1998 | Data last reviewed in December, 1968 |
Liquid Phase Heat Capacity (Shomate Equation)
Cp° = A + B*t + C*t2 + D*t3 +
E/t2
H° − H°298.15= A*t + B*t2/2 +
C*t3/3 + D*t4/4 − E/t + F − H
S° = A*ln(t) + B*t + C*t2/2 + D*t3/3 −
E/(2*t2) + G
Cp = heat capacity (cal/mol*K)
H° = standard enthalpy (kcal/mol)
S° = standard entropy (cal/mol*K)
t = temperature (K) / 1000.
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Temperature (K) | 428. to 1500. |
---|---|
A | 37.40010 |
B | -6.847469×10-10 |
C | 7.483631×10-10 |
D | -2.582959×10-10 |
E | -5.192840×10-12 |
F | -94.40000 |
G | 119.7920 |
H | -83.24909 |
Reference | Chase, 1998 |
Comment | Data last reviewed in December, 1968 |
Solid Phase Heat Capacity (Shomate Equation)
Cp° = A + B*t + C*t2 + D*t3 +
E/t2
H° − H°298.15= A*t + B*t2/2 +
C*t3/3 + D*t4/4 − E/t + F − H
S° = A*ln(t) + B*t + C*t2/2 + D*t3/3 −
E/(2*t2) + G
Cp = heat capacity (cal/mol*K)
H° = standard enthalpy (kcal/mol)
S° = standard entropy (cal/mol*K)
t = temperature (K) / 1000.
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Temperature (K) | 298. to 379. | 379. to 428. |
---|---|---|
A | 17.40490 | 35.40010 |
B | 41.91281 | -3.318201×10-12 |
C | 0.000000 | 0.000000 |
D | 0.000000 | 0.000000 |
E | 0.011098 | -7.673860×10-13 |
F | -96.81489 | -98.28411 |
G | 67.46049 | 107.0200 |
H | -89.80000 | -89.80000 |
Reference | Chase, 1998 | Chase, 1998 |
Comment | Data last reviewed in December, 1968 | Data last reviewed in December, 1968 |
Phase change 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 by: William E. Acree, Jr., James S. Chickos
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
14.0 | 538. | Blocher and Campbell, 1947 | Based on data from 433. to 643. K. |
Vibrational and/or electronic energy levels
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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 by: Takehiko Shimanouchi
Symmetry: Td Symmetry Number σ = 12
Sym. | No | Approximate | Selected Freq. | Infrared | Raman | Comments | ||||
---|---|---|---|---|---|---|---|---|---|---|
Species | type of mode | Value | Rating | Value | Phase | Value | Phase | |||
a1 | 1 | Sym str | 162 | D | ia | 162 VS p | solid solid | |||
e | 2 | Deg deform | 51 | D | ia | 51 M dp | solid solid | |||
f2 | 3 | Deg str | 322 | D | 322 VS | solid solid | 324 M dp | solid solid | ||
f2 | 4 | Deg deform | 67 | D | 67 M | solid solid | ||||
Source: Shimanouchi, 1972
Notes
VS | Very strong |
M | Medium |
ia | Inactive |
p | Polarized |
dp | Depolarized |
D | 6~15 cm-1 uncertainty |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Vibrational and/or electronic energy levels, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Chase, 1998
Chase, M.W., Jr.,
NIST-JANAF Themochemical Tables, Fourth Edition,
J. Phys. Chem. Ref. Data, Monograph 9, 1998, 1-1951. [all data]
Blocher and Campbell, 1947
Blocher, John M.; Campbell, Ivor E.,
The Vapor Pressure of Liquid Titanium Tetraiodide,
J. Am. Chem. Soc., 1947, 69, 9, 2100-2101, https://doi.org/10.1021/ja01201a006
. [all data]
Shimanouchi, 1972
Shimanouchi, T.,
Tables of Molecular Vibrational Frequencies Consolidated Volume II,
J. Phys. Chem. Ref. Data, 1972, 6, 3, 993-1102. [all data]
Notes
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- Symbols used in this document:
S°gas,1 bar Entropy of gas at standard conditions (1 bar) S°liquid,1 bar Entropy of liquid at standard conditions (1 bar) S°solid Entropy of solid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°liquid Enthalpy of formation of liquid at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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