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Gas Phase Heat Capacity (Shomate Equation)

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

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 6000.
A 8.934730
B 0.394538
C -0.001759
D 0.000150
E -0.020381
F 76.75041
G 77.82051
H 79.50010
ReferenceChase, 1998
Comment Data last reviewed in September, 1963
Temperature
(K)
Cp
(cal/mol*K)

(cal/mol*K)
-(G° - H°298.15)/T
(cal/mol*K)
H° - H°298.15
(kcal/mol)
298.8.8267.2467.24-0.00
300.8.8367.2967.240.02
400.8.9669.8667.590.91
500.9.0571.8768.251.81
600.9.1173.5268.992.72
700.9.1774.9369.743.63
800.9.2276.1670.474.55
900.9.2677.2571.165.47
1000.9.3178.2271.826.40
1100.9.3579.1172.457.34
1200.9.3979.9373.048.27
1300.9.4380.6873.609.21
1400.9.4781.3874.1310.16
1500.9.5182.0474.6311.11
1600.9.5582.6575.1112.06
1700.9.5983.2375.5813.02
1800.9.6383.7876.0213.98
1900.9.6784.3076.4414.95
2000.9.7184.8076.8415.91
2100.9.7585.2877.2316.89
2200.9.7985.7377.6117.87
2300.9.8386.1777.9718.85
2400.9.8786.5978.3219.83
2500.9.9186.9978.6620.82
2600.9.9587.3878.9921.81
2700.9.9987.7679.3122.81
2800.10.0388.1279.6223.81
2900.10.0788.4779.9224.82
3000.10.1088.8180.2125.82
3100.10.1489.1580.4926.84
3200.10.1889.4780.7727.85
3300.10.2289.7881.0328.87
3400.10.2690.0981.3029.90
3500.10.3090.3981.5530.92
3600.10.3490.6881.8031.96
3700.10.3890.9682.0432.99
3800.10.4291.2482.2834.03
3900.10.4591.5182.5235.08
4000.10.4991.7782.7436.12
4100.10.5392.0382.9737.17
4200.10.5792.2983.1938.23
4300.10.6192.5483.4039.29
4400.10.6592.7883.6140.35
4500.10.6993.0283.8241.42
4600.10.7393.2684.0242.49
4700.10.7693.4984.2243.56
4800.10.8093.7284.4144.64
4900.10.8493.9484.6145.72
5000.10.8894.1684.8046.81
5100.10.9294.3784.9847.90
5200.10.9694.5985.1648.99
5300.11.0094.8085.3450.09
5400.11.0495.0085.5251.19
5500.11.0895.2085.7052.30
5600.11.1195.4085.8753.41
5700.11.1595.6086.0454.52
5800.11.1995.8086.2055.64
5900.11.2395.9986.3756.76
6000.11.2796.1886.5357.89

References

Go To: Top, Gas Phase Heat Capacity (Shomate Equation), 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]


Notes

Go To: Top, Gas Phase Heat Capacity (Shomate Equation), References