{ "ANCILLARIES": { "hL": { "A": [ -66967.61389892508, -351.96262316200523, 6.372683721411762, -0.0348314581242093, 0.00010806159411976308, -1.9892518845358298e-07, 2.0092965982548803e-10, -8.615047635703894e-14 ], "B": [ 1, -0.0020357885206243207 ], "Tmax": 487.11, "Tmin": 236.93, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 409.858498633359, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "hLV": { "A": [ -40286.738918907715, 1798.914162096132, -18.49771979230961, 0.09678905404295263, -0.0002962803903159018, 5.355166989243426e-07, -5.3135107676116e-10, 2.241873477265807e-13 ], "B": [ 1, -0.00203477731758455 ], "Tmax": 487.11, "Tmin": 236.93, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 818.6958632736778, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "pS": { "T_r": 487.21, "Tmax": 487.2099999999988, "Tmin": 236.93, "description": "p'' = pc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 0.00783381539131156, "n": [ -7.513797278929454, 1.5095312092676123, -1.9699733346499353, 1.7578730760232852, -4.592035089583662, -0.41772646096774985 ], "reducing_value": 3392200.0, "t": [ 1.0, 1.296, 2.592, 3.34, 4.285, 10.465 ], "type": "pV", "using_tau_r": true }, "rhoL": { "T_r": 487.21, "Tmax": 487.2099999999988, "Tmin": 236.93, "description": "rho' = rhoc*(1+sum(n_i*theta^t_i))", "max_abserror_percentage": 0.8556608708030877, "n": [ 2.1209299719499692, 0.306929802490948, 107.2647341968565, -840.5575578947821, 1870.9104273285336, -1779.2226056266804 ], "reducing_value": 2988.6591060707137, "t": [ 0.344, 0.621, 4.847, 6.255, 7.527, 9.355 ], "type": "rhoLnoexp", "using_tau_r": false }, "rhoV": { "T_r": 487.21, "Tmax": 487.2099999999988, "Tmin": 236.93, "description": "rho'' = rhoc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 0.2213635863523744, "n": [ -53.51591930070364, 1179.0791709251655, -1132.4832595523026, 1.7901473308750928, -6.764890888618531, 2.256439191313591 ], "reducing_value": 2988.6591060707137, "t": [ 0.547, 0.639, 0.644, 1.238, 3.962, 5.593 ], "type": "rhoV", "using_tau_r": true }, "sL": { "A": [ -468.2616748238257, 3.2468905627962026, -0.010322123158165495, 1.5286164627771443e-05, 1.285663360909762e-08, -9.446683249083056e-11, 1.4585128338720422e-13, -7.877427559156162e-17 ], "B": [ 1, -0.0020356569157939713 ], "Tmax": 487.11, "Tmin": 236.93, "_note": "coefficients are in increasing order; input in K, output in J/mol/K; value is entropy minus hs_anchor entropy", "max_abs_error": 0.8462793351120332, "max_abs_error_units": "J/mol/K", "type": "rational_polynomial" }, "sLV": { "A": [ 888.3211478220155, -9.588121019203589, 0.04750023298521076, -0.00012764634906958528, 1.7009926804509758e-07, -4.154049563520062e-11, -1.4717242209192034e-13, 1.219421731423588e-16 ], "B": [ 1, -0.002034536398611937 ], "Tmax": 487.11, "Tmin": 236.93, "_note": "coefficients are in increasing order; input in K, output in J/mol/K; value is entropy minus hs_anchor entropy", "max_abs_error": 1.6958157421557, "max_abs_error_units": "J/mol/K", "type": "rational_polynomial" }, "surface_tension": { "BibTeX": "Mulero-JPCRD-2012", "Tc": 487.21, "a": [ 0.0556 ], "description": "sigma = sum(a_i*(1-T/Tc)^n_i)", "n": [ 1.24 ] } }, "EOS": [ { "BibTeX_CP0": "", "BibTeX_EOS": "Marx-BOOK-1992", "STATES": { "hs_anchor": { "T": 535.931, "T_units": "K", "hmolar": 93207.66727389816, "hmolar_units": "J/mol", "p": 5557400.090884164, "p_units": "Pa", "rhomolar": 2689.793195463643, "rhomolar_units": "mol/m^3", "smolar": 323.4623704691305, "smolar_units": "J/mol/K" }, "reducing": { "T": 487.21, "T_units": "K", "hmolar": 83544.06431989673, "hmolar_units": "J/mol", "p": 3392200, "p_units": "Pa", "rhomolar": 2988.659106070714, "rhomolar_units": "mol/m^3", "smolar": 306.03988806366687, "smolar_units": "J/mol/K" }, "sat_min_liquid": { "T": 236.93, "T_units": "K", "hmolar": 31483.569476399094, "hmolar_units": "J/mol", "p": 1871.4275472708046, "p_units": "Pa", "rhomolar": 9098.739101423036, "rhomolar_units": "mol/m^3", "smolar": 163.85661638324174, "smolar_units": "J/mol/K" }, "sat_min_vapor": { "T": 236.93, "T_units": "K", "hmolar": 63243.25491698857, "hmolar_units": "J/mol", "p": 1871.4275472708046, "p_units": "Pa", "rhomolar": 0.9519937553354061, "rhomolar_units": "mol/m^3", "smolar": 297.90329244375033, "smolar_units": "J/mol/K" } }, "T_max": 525, "T_max_units": "K", "Ttriple": 236.93, "Ttriple_units": "K", "acentric": 0.252535, "acentric_units": "-", "alpha0": [ { "a1": 13.1479282, "a2": -5.4053715, "type": "IdealGasHelmholtzLead" }, { "a": 2.9999966, "type": "IdealGasHelmholtzLogTau" }, { "n": [ 12.4464495, 2.72181845, 0.692712415, 3.32248298 ], "t": [ 1.04971737, 3.29788641, 8.62650812, 3.29670446 ], "type": "IdealGasHelmholtzPlanckEinstein" }, { "a1": -35.0036997726949, "a2": 17.3478156256033, "reference": "IIR", "type": "IdealGasHelmholtzEnthalpyEntropyOffset" } ], "alphar": [ { "d": [ 1, 1, 2, 3, 4, 8, 8, 3, 3, 3, 5, 1, 2, 2, 9, 3, 7, 8 ], "l": [ 0, 0, 0, 0, 0, 0, 0, 1, 1, 1, 1, 2, 2, 2, 2, 3, 3, 4 ], "n": [ 0.8432092286, -2.019185967, 0.2920612996, 0.05323107661, 0.003214971931, 4.667858574e-05, -1.227522799e-06, 0.8167288718, -1.340790803, 0.4065752705, -0.1534754634, -0.02414435149, -0.02113056197, -0.03565436205, 0.001364654968, -0.01251838755, -0.001385761351, 0.0007206335486 ], "t": [ 0.5, 1.5, 1.5, -0.5, 2, 0, 3, -0.5, 0, 2, 1.5, 6, 2, 10, 6, 18, 15, 33 ], "type": "ResidualHelmholtzPower" } ], "critical_region_splines": { "T_max": 487.21000000000004, "T_min": 487.2099540373214, "_note": "Coefficients for the critical cubic spline. T = c[0]*rho^3 + c[1]*rho^2 + c[2]*rho + c[3] with rho in mol/m^3 and T in K", "cL": [ 0.0, 0.0, -5.934357667529962e-06, 487.22773577208176 ], "cV": [ 0.0, 0.0, 6.04290259183351e-06, 487.19193982414185 ], "rhomolar_max": 2996.404287808557, "rhomolar_min": 2981.053046244005 }, "gas_constant": 8.314471, "gas_constant_units": "J/mol/K", "molar_mass": 0.187375, "molar_mass_units": "kg/mol", "p_max": 200000000, "p_max_units": "Pa", "pseudo_pure": false } ], "INFO": { "2DPNG_URL": "http://www.chemspider.com/ImagesHandler.ashx?id=6188", "ALIASES": [], "CAS": "76-13-1", "CHEMSPIDER_ID": 6188, "ENVIRONMENTAL": { "ASHRAE34": "A1", "FH": 0, "GWP100": 6130.0, "GWP20": 6540.0, "GWP500": 2700.0, "HH": 1, "Name": "R113", "ODP": 1.0, "PH": 0 }, "FORMULA": "C_{2}Cl_{3}F_{3}", "INCHI_KEY": "AJDIZQLSFPQPEY-UHFFFAOYSA-N", "INCHI_STRING": "InChI=1S/C2Cl3F3/c3-1(4,6)2(5,7)8", "NAME": "R113", "REFPROP_NAME": "R113", "SMILES": "C(C(F)(Cl)Cl)(F)(F)Cl" }, "STATES": { "critical": { "T": 487.21000000000004, "T_units": "K", "hmolar": 83535.69764486028, "hmolar_units": "J/mol", "p": 3392200.0, "p_units": "Pa", "rhomolar": 2988.6591060707137, "rhomolar_units": "mol/m^3", "smolar": 306.0244020822611, "smolar_units": "J/mol/K" }, "triple_liquid": { "T": 236.93, "T_units": "K", "hmolar": 31483.569476399094, "hmolar_units": "J/mol", "p": 1871.4275472708046, "p_units": "Pa", "rhomolar": 9098.739101423036, "rhomolar_units": "mol/m^3", "smolar": 163.85661638324174, "smolar_units": "J/mol/K" }, "triple_vapor": { "T": 236.93, "T_units": "K", "hmolar": 63243.25491698857, "hmolar_units": "J/mol", "p": 1871.4275472708046, "p_units": "Pa", "rhomolar": 0.9519937553354061, "rhomolar_units": "mol/m^3", "smolar": 297.90329244375033, "smolar_units": "J/mol/K" } } }