| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.1710 | KDB | |
| PAff | 664.30 | kJ/mol | NIST |
| BasG | 640.20 | kJ/mol | NIST |
| EA | [2.02; 2.08] | eV |
|
| EA | 2.02 ± 0.00 | eV | NIST |
| EA | 2.08 ± 0.00 | eV | NIST |
| EA | 2.07 ± 0.13 | eV | NIST |
| EA | 2.08 ± 0.00 | eV | NIST |
| ΔfG° | 238.60 | kJ/mol | KDB |
| ΔfH°gas | [277.17; 279.20] | kJ/mol |
|
| ΔfH°gas | 279.20 | kJ/mol | KDB |
| ΔfH°gas | 277.17 ± 0.15 | kJ/mol | NIST |
| IE | [10.30; 11.00] | eV |
|
| IE | 10.36 | eV | NIST |
| IE | 10.36 | eV | NIST |
| IE | 10.36 | eV | NIST |
| IE | 10.36 | eV | NIST |
| IE | 10.40 ± 0.30 | eV | NIST |
| IE | 10.40 ± 0.30 | eV | NIST |
| IE | 10.36 | eV | NIST |
| IE | 10.50 ± 0.30 | eV | NIST |
| IE | 10.50 | eV | NIST |
| IE | 10.50 ± 0.30 | eV | NIST |
| IE | 10.50 ± 0.30 | eV | NIST |
| IE | 10.30 ± 0.30 | eV | NIST |
| IE | 10.36 | eV | NIST |
| IE | Outlier 11.00 ± 0.50 | eV | NIST |
| Pc | [11753.70; 20700.00] | kPa |
|
| Pc | 11753.70 | kPa | Mathews (1972), critical constants of inorganic substances Compiled value |
| Pc | 20700.00 | kPa | KDB |
| Pc | 18208.10 ± 18.18 | kPa | NIST |
| ρc | 564.34 ± 5.61 | kg/m3 | NIST |
| S°gas,1 bar | 167.83 ± 0.01 | J/mol×K | NIST |
| S°solid,1 bar | 32.05 ± 0.05 | J/mol×K | NIST |
| Tboil | 717.75 | K | KDB |
| Tc | [1313.00; 1314.00] | K |
|
| Tc | 1314.00 | K | Mathews (1972), critical constants of inorganic substances Compiled value |
| Tc | 1314.00 | K | KDB |
| Tc | 1313.00 ± 1.31 | K | NIST |
| Tfus | [286.40; 388.36] | K |
|
| Tfus | 286.40 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 388.36 | K | KDB |
| Ttriple | 388.33 | K | KDB |
Cheméo can also estimate Critical Volume, Enthalpy of vaporization at standard conditions, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [21.64; 21.20] | J/mol×K | [882.12; 1400.00] |
NIST
|
| Equation | Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 2.74597e+01 | |||
| Coefficient B | -1.33278e+01 | |||
| Coefficient C | 1.00657e+01 | |||
| Coefficient D | -2.66238e+00 | |||
| Coefficient E | -5.58510e-02 | |||
| Reference | Chase, 1998 | |||
| Comment | F=269.1149, G=204.2955, H=276.9804; Data last reviewed in September, 1977 | |||
| Temperature range, min. | 882.12 | |||
| Temperature range, max. | 1400.00 | |||
| Cp,gas | 21.64 | J/mol×K | 882.12 | Calculated Property |
| Cp,gas | 21.55 | J/mol×K | 939.66 | Calculated Property |
| Cp,gas | 21.48 | J/mol×K | 997.20 | Calculated Property |
| Cp,gas | 21.43 | J/mol×K | 1054.74 | Calculated Property |
| Cp,gas | 21.38 | J/mol×K | 1112.29 | Calculated Property |
| Cp,gas | 21.34 | J/mol×K | 1169.83 | Calculated Property |
| Cp,gas | 21.31 | J/mol×K | 1227.37 | Calculated Property |
| Cp,gas | 21.27 | J/mol×K | 1284.91 | Calculated Property |
| Cp,gas | 21.24 | J/mol×K | 1342.46 | Calculated Property |
| Cp,gas | 21.20 | J/mol×K | 1400.00 | Calculated Property |
| Cp,gas | [21.25; 23.10] | J/mol×K | [1400.00; 6000.00] |
NIST
|
| Equation | Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 1.65535e+01 | |||
| Coefficient B | 2.40027e+00 | |||
| Coefficient C | -2.55760e-01 | |||
| Coefficient D | 5.82100e-03 | |||
| Coefficient E | 3.56479e+00 | |||
| Reference | Chase, 1998 | |||
| Comment | F=278.4356, G=194.5447, H=276.9804; Data last reviewed in September, 1977 | |||
| Temperature range, min. | 1400.00 | |||
| Temperature range, max. | 6000.00 | |||
| Cp,gas | 21.25 | J/mol×K | 1400.00 | Calculated Property |
| Cp,gas | 21.22 | J/mol×K | 1911.11 | Calculated Property |
| Cp,gas | 21.56 | J/mol×K | 2422.22 | Calculated Property |
| Cp,gas | 21.95 | J/mol×K | 2933.33 | Calculated Property |
| Cp,gas | 22.32 | J/mol×K | 3444.44 | Calculated Property |
| Cp,gas | 22.63 | J/mol×K | 3955.56 | Calculated Property |
| Cp,gas | 22.87 | J/mol×K | 4466.67 | Calculated Property |
| Cp,gas | 23.03 | J/mol×K | 4977.78 | Calculated Property |
| Cp,gas | 23.10 | J/mol×K | 5488.89 | Calculated Property |
| Cp,gas | 23.10 | J/mol×K | 6000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | [30.79; 37.47] | J/mol×K | [388.36; 432.00] |
NIST
|
| Equation | Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,liquid in J/mol×K, T in K | |||
| Coefficient A | -4.54097e+03 | |||
| Coefficient B | 2.60656e+04 | |||
| Coefficient C | -5.55207e+04 | |||
| Coefficient D | 4.20122e+04 | |||
| Coefficient E | 5.45886e+01 | |||
| Reference | Chase, 1998 | |||
| Comment | F=787.8070, G=-10826.30, H=1.853781; Data last reviewed in September, 1977 | |||
| Temperature range, min. | 388.36 | |||
| Temperature range, max. | 432.00 | |||
| Cp,liquid | 30.79 | J/mol×K | 388.36 | Calculated Property |
| Cp,liquid | 31.23 | J/mol×K | 393.21 | Calculated Property |
| Cp,liquid | 31.71 | J/mol×K | 398.06 | Calculated Property |
| Cp,liquid | 32.25 | J/mol×K | 402.91 | Calculated Property |
| Cp,liquid | 32.85 | J/mol×K | 407.76 | Calculated Property |
| Cp,liquid | 33.54 | J/mol×K | 412.60 | Calculated Property |
| Cp,liquid | 34.33 | J/mol×K | 417.45 | Calculated Property |
| Cp,liquid | 35.24 | J/mol×K | 422.30 | Calculated Property |
| Cp,liquid | 36.28 | J/mol×K | 427.15 | Calculated Property |
| Cp,liquid | 37.47 | J/mol×K | 432.00 | Calculated Property |
| Cp,liquid | [44.79; 31.74] | J/mol×K | [432.00; 882.12] |
NIST
|
| Equation | Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,liquid in J/mol×K, T in K | |||
| Coefficient A | -3.79335e+01 | |||
| Coefficient B | 1.33242e+02 | |||
| Coefficient C | -9.53245e+01 | |||
| Coefficient D | 2.40094e+01 | |||
| Coefficient E | 7.65453e+00 | |||
| Reference | Chase, 1998 | |||
| Comment | F=29.78810, G=-13.15340, H=1.853781; Data last reviewed in September, 1977 | |||
| Temperature range, min. | 432.00 | |||
| Temperature range, max. | 882.12 | |||
| Cp,liquid | 44.79 | J/mol×K | 432.00 | Calculated Property |
| Cp,liquid | 39.78 | J/mol×K | 482.01 | Calculated Property |
| Cp,liquid | 36.63 | J/mol×K | 532.03 | Calculated Property |
| Cp,liquid | 34.65 | J/mol×K | 582.04 | Calculated Property |
| Cp,liquid | 33.42 | J/mol×K | 632.05 | Calculated Property |
| Cp,liquid | 32.67 | J/mol×K | 682.07 | Calculated Property |
| Cp,liquid | 32.22 | J/mol×K | 732.08 | Calculated Property |
| Cp,liquid | 31.97 | J/mol×K | 782.09 | Calculated Property |
| Cp,liquid | 31.82 | J/mol×K | 832.10 | Calculated Property |
| Cp,liquid | 31.74 | J/mol×K | 882.12 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,solid | [22.70; 24.66] | J/mol×K | [298.00; 388.36] |
NIST
|
| Equation | Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,solid in J/mol×K, T in K | |||
| Coefficient A | 2.12198e+01 | |||
| Coefficient B | 3.86586e+00 | |||
| Coefficient C | 2.22746e+01 | |||
| Coefficient D | -1.03191e+01 | |||
| Coefficient E | -1.22518e-01 | |||
| Reference | Chase, 1998 | |||
| Comment | F=-7.085604, G=54.99575, H=0.000000; orthorhombic phase; Data last reviewed in September, 1977 | |||
| Temperature range, min. | 298.00 | |||
| Temperature range, max. | 388.36 | |||
| Cp,solid | 22.70 | J/mol×K | 298.00 | Calculated Property |
| Cp,solid | 22.93 | J/mol×K | 308.04 | Calculated Property |
| Cp,solid | 23.16 | J/mol×K | 318.08 | Calculated Property |
| Cp,solid | 23.38 | J/mol×K | 328.12 | Calculated Property |
| Cp,solid | 23.60 | J/mol×K | 338.16 | Calculated Property |
| Cp,solid | 23.82 | J/mol×K | 348.20 | Calculated Property |
| Cp,solid | 24.03 | J/mol×K | 358.24 | Calculated Property |
| Cp,solid | 24.25 | J/mol×K | 368.28 | Calculated Property |
| Cp,solid | 24.46 | J/mol×K | 378.32 | Calculated Property |
| Cp,solid | 24.66 | J/mol×K | 388.36 | Calculated Property |
| Cp,solid | [23.23; 25.18] | J/mol×K | [298.00; 388.36] |
NIST
|
| Equation | Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,solid in J/mol×K, T in K | |||
| Coefficient A | 2.42375e+01 | |||
| Coefficient B | -4.98306e+00 | |||
| Coefficient C | 3.30090e+01 | |||
| Coefficient D | -1.52962e+01 | |||
| Coefficient E | -1.82237e-01 | |||
| Reference | Chase, 1998 | |||
| Comment | F=-7.516263, G=61.49141, H=0.360001; monoclinic phase; Data last reviewed in September, 1977 | |||
| Temperature range, min. | 298.00 | |||
| Temperature range, max. | 388.36 | |||
| Cp,solid | 23.23 | J/mol×K | 298.00 | Calculated Property |
| Cp,solid | 23.47 | J/mol×K | 308.04 | Calculated Property |
| Cp,solid | 23.70 | J/mol×K | 318.08 | Calculated Property |
| Cp,solid | 23.92 | J/mol×K | 328.12 | Calculated Property |
| Cp,solid | 24.14 | J/mol×K | 338.16 | Calculated Property |
| Cp,solid | 24.36 | J/mol×K | 348.20 | Calculated Property |
| Cp,solid | 24.57 | J/mol×K | 358.24 | Calculated Property |
| Cp,solid | 24.77 | J/mol×K | 368.28 | Calculated Property |
| Cp,solid | 24.98 | J/mol×K | 378.32 | Calculated Property |
| Cp,solid | 25.18 | J/mol×K | 388.36 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.44e-03; 100.20] | kPa | [375.15; 717.15] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.60978e+01 | |||
| Coefficient B | -7.97842e+03 | |||
| Coefficient C | -2.28100e+01 | |||
| Temperature range, min. | 375.15 | |||
| Temperature range, max. | 717.15 | |||
| Pvap | 1.44e-03 | kPa | 375.15 | Calculated Property |
| Pvap | 0.01 | kPa | 413.15 | Calculated Property |
| Pvap | 0.08 | kPa | 451.15 | Calculated Property |
| Pvap | 0.36 | kPa | 489.15 | Calculated Property |
| Pvap | 1.32 | kPa | 527.15 | Calculated Property |
| Pvap | 4.00 | kPa | 565.15 | Calculated Property |
| Pvap | 10.49 | kPa | 603.15 | Calculated Property |
| Pvap | 24.41 | kPa | 641.15 | Calculated Property |
| Pvap | 51.52 | kPa | 679.15 | Calculated Property |
| Pvap | 100.20 | kPa | 717.15 | Calculated Property |
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