{ "ANCILLARIES": { "hL": { "A": [ -333017.46941876225, 936.7820718404636, -1.2477198801641327, 0.002008423569184849, -7.596872483253868e-07, -4.720202600073577e-09, 7.217753928073089e-12, -3.3122367046153366e-15 ], "B": [ 1, -0.0015063041223349418 ], "Tmax": 658.0, "Tmin": 263.6, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 579.6275198066214, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "hLV": { "A": [ 62638.116293381754, 392.4418740131987, -5.134074163994587, 0.022810201539664402, -5.5994070365431146e-05, 7.973436702565313e-08, -6.197731365073001e-11, 2.0511105575523753e-14 ], "B": [ 1, -0.0015041380491953413 ], "Tmax": 658.0, "Tmin": 263.6, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 1400.7467512743715, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "pS": { "T_r": 658.1, "Tmax": 658.0999999999985, "Tmin": 263.6, "description": "p'' = pc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 0.03129828340833196, "n": [ 0.01855892414806427, -7.941228211958365, 0.7027032448570503, -1.6469727356969044, -6.161545669379877, -1.4874349910776694 ], "reducing_value": 1817000.0, "t": [ 0.435, 0.972, 1.704, 2.29, 3.72, 9.501 ], "type": "pV", "using_tau_r": true }, "rhoL": { "T_r": 658.1, "Tmax": 658.0999999999985, "Tmin": 263.6, "description": "rho' = rhoc*(1+sum(n_i*theta^t_i))", "max_abserror_percentage": 0.06226133770144138, "n": [ 169.6307007144784, -170.78856038865672, 4.362812034890246, -0.46704708251799704, 3.942637021143127, -4.234606611460045 ], "reducing_value": 1330.0, "t": [ 0.312, 0.314, 0.53, 1.689, 5.186, 6.344 ], "type": "rhoLnoexp", "using_tau_r": false }, "rhoV": { "T_r": 658.1, "Tmax": 658.0999999999985, "Tmin": 263.6, "description": "rho'' = rhoc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 1.4284240304967444, "n": [ -3.1027406450131076, 659.6310704998223, -2132.1075657465976, 1475.1968821648827, -19.394230255247603, 6.056907847881279 ], "reducing_value": 1330.0, "t": [ 0.369, 1.31, 1.357, 1.383, 3.194, 4.632 ], "type": "rhoV", "using_tau_r": true }, "sL": { "A": [ -1197.964408711376, 7.283955302109097, -0.027562429195260404, 7.665234045876982e-05, -1.3972689458809733e-07, 1.547172902238928e-10, -9.508697239574042e-14, 2.484762250653834e-17 ], "B": [ 1, -0.00150382945103474 ], "Tmax": 658.0, "Tmin": 263.6, "_note": "coefficients are in increasing order; 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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, -2.0939062487280465e-07, 0.0005569790621618195, 657.7296089236623 ], "cV": [ 1.3346771828287604e-08, -5.346984610199855e-05, 0.07140247657014234, 626.3174076977489 ], "rhomolar_max": 1408.694372900752, "rhomolar_min": 1288.843365778471 }, "gas_constant": 8.314472, "gas_constant_units": "J/mol/K", "molar_mass": 0.17033484, "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=7890", "ALIASES": [ "nDodecane", "Dodecane", "DODECANE", "N-DODECANE", "C12", "NC12H26", "n-C12H26" ], "CAS": "112-40-3", "CHEMSPIDER_ID": 7890, "ENVIRONMENTAL": { "ASHRAE34": "UNKNOWN", "FH": 2, "GWP100": -1.0, "GWP20": -1.0, "GWP500": -1.0, "HH": 2, "Name": "n-Dodecane", "ODP": -1.0, "PH": 0 }, "FORMULA": "C_{12}H_{26}", "INCHI_KEY": "SNRUBQQJIBEYMU-UHFFFAOYSA-N", "INCHI_STRING": "InChI=1S/C12H26/c1-3-5-7-9-11-12-10-8-6-4-2/h3-12H2,1-2H3", "NAME": "n-Dodecane", "REFPROP_NAME": "C12", "SMILES": "CCCCCCCCCCCC" }, "STATES": { "critical": { "T": 658.1, "T_units": "K", "hmolar": 102723.14091498662, "hmolar_units": "J/mol", "p": 1817000.0, "p_units": "Pa", "rhomolar": 1330.0, "rhomolar_units": "mol/m^3", "smolar": 176.82801841955285, "smolar_units": "J/mol/K" }, "triple_liquid": { "T": 263.6, "T_units": "K", "hmolar": -96620.71540993423, "hmolar_units": "J/mol", "p": 0.62621086350047, "p_units": "Pa", "rhomolar": 4529.146373639824, "rhomolar_units": "mol/m^3", "smolar": -260.0267042569149, "smolar_units": "J/mol/K" }, "triple_vapor": { "T": 263.6, "T_units": "K", "hmolar": -31507.360350731822, "hmolar_units": "J/mol", "p": 0.6262109341098063, "p_units": "Pa", "rhomolar": 0.00028572146902878707, "rhomolar_units": "mol/m^3", "smolar": -13.010941653604602, "smolar_units": "J/mol/K" } }, "TRANSPORT": { "conductivity": { "BibTeX": "Huber-EF-2004", "critical": { "GAMMA": 0.0496, "R0": 1.03, "gamma": 1.239, "qD": 657894736.842, "type": "simplified_Olchowy_Sengers", "zeta0": 1.94e-10 }, "dilute": { "A": [ 0.00436343, -0.0264054, 0.0922394, -0.0291756 ], "B": [ 1.0 ], "T_reducing": 658.1, "T_reducing_units": "K", "m": [ 0 ], "n": [ 0, 1, 2, 3 ], "type": "ratio_of_polynomials" }, "residual": { "B": [ 0.0693347, -0.0331695, 0.00676165, -0.0280792, 0.00173922, 0.00309558 ], "T_reducing": 658.1, "T_reducing_units": "K", "d": [ 1, 2, 3, 1, 2, 3 ], "rhomass_reducing": 226.545337, "rhomass_reducing_units": "kg/m^3", "t": [ 0, 0, 0, -1, -1, -1 ], "type": "polynomial" } }, "viscosity": { "BibTeX": "Huber-EF-2004", "dilute": { "C": 2.1357e-08, "a": [ 0.382987, -0.56105, 0.0313962 ], "molar_mass": 0.17033, "molar_mass_units": "kg/mol", "t": [ 0, 1, 2 ], "type": "collision_integral" }, "epsilon_over_k": 522.592, "epsilon_over_k_units": "K", "higher_order": { "T_reduce": 658.1, "T_reduce_units": "K", "a": [ -4.71703e-05, 2.98429e-05, 8.27816e-06, -1.34156e-05 ], "d1": [ 2, 2, 3, 3 ], "d2": [ 1 ], "f": [ 0.000503109 ], "g": [ 2.32661, 2.23089 ], "gamma": [ 0, 0, 0, 0 ], "h": [ 0, -0.5 ], "l": [ 1, 1, 1, 1 ], "p": [ 1 ], "q": [ 0 ], "rhomolar_reduce": 1330.0, "rhomolar_reduce_units": "mol/m^3", "t1": [ 1, 2, 1, 2 ], "t2": [ 0 ], "type": "modified_Batschinski_Hildebrand" }, "initial_density": { "b": [ -19.572881, 219.73999, -1015.3226, 2471.01251, -3375.1717, 2491.6597, -787.26086, 14.085455, -0.34664158 ], "t": [ 0, -0.25, -0.5, -0.75, -1.0, -1.25, -1.5, -2.5, -5.5 ], "type": "Rainwater-Friend" }, "sigma_eta": 7.35639e-10, "sigma_eta_units": "m" } } }