ABSTRACT

Excess heat capacities, oCEP Pijk of {1-methylpyrrolidin-2-one (i) + benzene (j) + o- or m- or p-chlorotoluene (k)} and CEP of their sub-binary {1-methylpyrrolidin-2-one (i) + benzene (j)}; {benzene (i) + m- or p-chlorotoluene (j)} mixtures have been determined using their measured heat capacities data at T = (293.15, 298.15, 303.15) K and 0.1 MPa using micro differential scanning calorimeter. The results are discussed in terms of Graph (which deals with the topology of the constituent molecules) theory. The results suggest that CEP and oCEP Pijk values commuted by Graph theory compare well with experimental values.

Compounds

#	Formula	Name
1	C5H9NO	N-methylpyrrolidone
2	C6H6	benzene
3	C7H7Cl	3-chlorotoluene
4	C7H7Cl	4-chlorotoluene
5	C7H7Cl	2-chlorotoluene

Datasets

The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type	Compound-#	Property	Variable	Constraint	Phase	Method	#Points
POMD	1	Mass density, kg/m3 ; Liquid	Temperature, K; Liquid	Pressure, kPa; Liquid	Liquid	Vibrating tube method	3
POMD	1	Speed of sound, m/s ; Liquid	Temperature, K; Liquid	Pressure, kPa; Liquid	Liquid	Sing-around technique in a fixed-path interferometer	3
POMD	1	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	3
POMD	2	Mass density, kg/m3 ; Liquid	Temperature, K; Liquid	Pressure, kPa; Liquid	Liquid	Vibrating tube method	3
POMD	2	Speed of sound, m/s ; Liquid	Temperature, K; Liquid	Pressure, kPa; Liquid	Liquid	Sing-around technique in a fixed-path interferometer	3
POMD	2	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	3
POMD	2 1	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid Mole fraction - 1; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	72
POMD	2 3	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid Mole fraction - 2; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	72
POMD	2 4	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid Mole fraction - 2; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	72
POMD	2 5 1	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid Mole fraction - 1; Liquid Mole fraction - 2; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	90
POMD	2 3 1	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid Mole fraction - 1; Liquid Mole fraction - 2; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	90
POMD	2 4 1	Molar heat capacity at constant pressure, J/K/mol ; Liquid	Temperature, K; Liquid Mole fraction - 1; Liquid Mole fraction - 2; Liquid	Pressure, kPa; Liquid	Liquid	Small sample (50 mg) DSC	102

Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Excess heat capacities of mixtures containing 1-methylpyrrolidin-2-one, chlorotoluenes and benzene

Sharma, V. K., Rohilla, A., Bhagour, S., Yadav, J. S.

ABSTRACT