Property | Value | Unit | Source |
---|---|---|---|
PAff | 905.90 | kJ/mol | NIST |
BasG | 874.00 | kJ/mol | NIST |
ΔcH°solid | [-3511.00; -3507.40] | kJ/mol |
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ΔcH°solid | -3511.00 ± 3.00 | kJ/mol | NIST |
ΔcH°solid | -3507.40 ± 0.63 | kJ/mol | NIST |
ΔcH°solid | -3509.30 ± 0.63 | kJ/mol | NIST |
ΔfG° | 235.32 | kJ/mol | Joback Calculated Property |
ΔfH°gas | 125.47 | kJ/mol | Joback Calculated Property |
ΔfH°solid | 6.30 | kJ/mol | NIST |
ΔfusH° | 15.34 | kJ/mol | Joback Calculated Property |
ΔsubH° | 92.20 ± 0.20 | kJ/mol | NIST |
ΔvapH° | 53.17 | kJ/mol | Joback Calculated Property |
IE | [6.84; 7.61] | eV |
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IE | 6.87 ± 0.05 | eV | NIST |
IE | 6.84 | eV | NIST |
IE | 7.16 | eV | NIST |
IE | 6.89 ± 0.03 | eV | NIST |
IE | 7.00 ± 0.10 | eV | NIST |
IE | 7.58 | eV | NIST |
IE | 7.15 | eV | NIST |
IE | 7.34 | eV | NIST |
IE | 7.61 | eV | NIST |
IE | 7.34 | eV | NIST |
log10WS | -0.38 | Aq. Sol... | |
logPoct/wat | 0.851 | Crippen Calculated Property | |
McVol | 91.600 | ml/mol | McGowan Calculated Property |
Pc | 5374.91 | kPa | Joback Calculated Property |
Inp | 212.86 | NIST | |
S°solid,1 bar | 149.70 | J/mol×K | NIST |
Tboil | 540.20 | K | NIST |
Tc | 757.17 | K | Joback Calculated Property |
Tfus | [412.30; 415.70] | K |
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Tfus | 412.30 ± 0.50 | K | NIST |
Tfus | 415.70 ± 0.10 | K | NIST |
Tfus | 414.20 ± 0.20 | K | NIST |
Tfus | 414.14 ± 0.30 | K | NIST |
Tfus | 414.35 ± 0.20 | K | NIST |
Vc | 0.322 | m3/kmol | Joback Calculated Property |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Cp,gas | [195.92; 247.46] | J/mol×K | [513.40; 757.17] | ![]() |
T(K) Ideal gas heat capacity (J/mol×K) 200 210 220 230 240 250 600 700 | ||||
Cp,gas | 195.92 | J/mol×K | 513.40 | Joback Calculated Property |
Cp,gas | 206.18 | J/mol×K | 554.03 | Joback Calculated Property |
Cp,gas | 215.73 | J/mol×K | 594.66 | Joback Calculated Property |
Cp,gas | 224.60 | J/mol×K | 635.29 | Joback Calculated Property |
Cp,gas | 232.82 | J/mol×K | 675.91 | Joback Calculated Property |
Cp,gas | 240.43 | J/mol×K | 716.54 | Joback Calculated Property |
Cp,gas | 247.46 | J/mol×K | 757.17 | Joback Calculated Property |
Cp,solid | 155.64 | J/mol×K | 300.00 | NIST |
ΔfusH | [21.70; 24.90] | kJ/mol | [412.30; 416.00] | ![]() |
ΔfusH | 21.70 | kJ/mol | 412.30 | NIST |
ΔfusH | 21.70 | kJ/mol | 412.30 | NIST |
ΔfusH | 24.90 | kJ/mol | 416.00 | NIST |
ΔfusS | 59.80 | J/mol×K | 416.00 | NIST |
Property | Value | Unit | Temperature (K) | Source |
---|---|---|---|---|
Pvap | [1.33; 202.66] | kPa | [412.47; 570.86] |
The Yaw...
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Equation | ln(Pvp) = A + B/(T + C) | |||
Coefficient A | 1.53683e+01 | |||
Coefficient B | -4.78156e+03 | |||
Coefficient C | -9.54010e+01 | |||
Temperature range, min. | 412.47 | |||
Temperature range, max. | 570.86 | |||
T(K) Vapor pressure (kPa) 0 50 100 150 200 450 500 550 | ||||
Pvap | 1.33 | kPa | 412.47 | Calculated Property |
Pvap | 2.95 | kPa | 430.07 | Calculated Property |
Pvap | 6.02 | kPa | 447.67 | Calculated Property |
Pvap | 11.48 | kPa | 465.27 | Calculated Property |
Pvap | 20.65 | kPa | 482.87 | Calculated Property |
Pvap | 35.30 | kPa | 500.46 | Calculated Property |
Pvap | 57.70 | kPa | 518.06 | Calculated Property |
Pvap | 90.70 | kPa | 535.66 | Calculated Property |
Pvap | 137.69 | kPa | 553.26 | Calculated Property |
Pvap | 202.66 | kPa | 570.86 | Calculated Property |
Pvap | [1.36; 5154.28] | kPa | [413.00; 796.00] |
KDB Vap...
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Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
Coefficient A | 1.17201e+02 | |||
Coefficient B | -1.32852e+04 | |||
Coefficient C | -1.41926e+01 | |||
Coefficient D | 4.47876e-06 | |||
Temperature range, min. | 413.00 | |||
Temperature range, max. | 796.00 | |||
T(K) Vapor pressure (kPa) 0 1000 2000 3000 4000 5000 500 600 700 800 | ||||
Pvap | 1.36 | kPa | 413.00 | Calculated Property |
Pvap | 8.06 | kPa | 455.56 | Calculated Property |
Pvap | 32.88 | kPa | 498.11 | Calculated Property |
Pvap | 102.18 | kPa | 540.67 | Calculated Property |
Pvap | 259.44 | kPa | 583.22 | Calculated Property |
Pvap | 565.94 | kPa | 625.78 | Calculated Property |
Pvap | 1100.13 | kPa | 668.33 | Calculated Property |
Pvap | 1958.46 | kPa | 710.89 | Calculated Property |
Pvap | 3259.71 | kPa | 753.44 | Calculated Property |
Pvap | 5154.28 | kPa | 796.00 | Calculated Property |
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