Beta version#
BETA TEST VERSION OF THIS ITEM
This online calculator is currently under heavy development. It may or it may NOT work correctly.
You CAN try to use it. You CAN even get the proper results.
However, please VERIFY all results on your own, as the level of completion of this item is NOT CONFIRMED.
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This online calculator is currently under heavy development. It may or it may NOT work correctly.
You CAN try to use it. You CAN even get the proper results.
However, please VERIFY all results on your own, as the level of completion of this item is NOT CONFIRMED.
Feel free to send any ideas and comments !
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liquids#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
acetone | (CH3)2CO | -152.6 |
glycerin | C3H5(OH)3 | -477.4 |
ethanol | C2H5OH | -184.3 |
methanol | CH3OH | -166.7 |
ethylene glycol | C2H4(OH)2 | -323.3 |
phenol | C6H5OH | 183.9 |
formic acid | HCOOH | -347 |
lactic acid | CH3CH(OH)COOH | -518.1 |
acetate acid | CH3COOH | -389 |
propionic acid | CH3CH2COOH | -384.6 |
benzaldehyde | C6H5COH | 6.4 |
methylamine | CH3NH2 | 29.6 |
phenylamine (aniline) | C6H5NH2 | 146.3 |
benzene | C6H6 | 123.8 |
orthoxylene | C6H4(CH3)2 | 110 |
metaxylene | C6H4(CH3)2 | 109.6 |
paraxylene | C6H4(CH3)2 | 108.5 |
chlorobenzene | C6H5Cl | 94 |
bromobenzene | C6H5Br | 112.3 |
pyridine | C5H5N | 158.4 |
diethyl ethere | (C2H5)2O | -116.3 |
nitromethane | CH3NO2 | 6.5 |
nitrobenzene | C6H5NO2 | 140 |
ethyl acetate | CH3COOC2H5 | -328.1 |
n-octane | C8H18 | 6.6 |
butter acid | CH3CH2CH2COOH | -377.3 |
acetonitrile | C2H3N | 88.8 |
acetylacetone | C5H8O2 | -306.9 |
benzyl alcohol | C7H8O | -27.8 |
benzonitrile | C7H5N | 258.1 |
acetic anhydride | C4H6O3 | -488.6 |
bromoethane | C2H5Br | -26.1 |
methyl methacrylate | C5H8O2 | -225 |
N-methylaniline | C7H9N | 178.1 |
methyl formate | C2H4O2 | -300.2 |
alcohols#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
ethanol | C2H5OH | -184.3 |
methanol | CH3OH | -166.7 |
ethylene glycol | C2H4(OH)2 | -323.3 |
benzyl alcohol | C7H8O | -27.8 |
gases#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
methane | CH4 | -50.6 |
n-buthane | C4H10 | -16.7 |
ethene (ethylene) | C2H4 | 68.3 |
ethyne | C2H2 | 210.7 |
formaldehyde (methanal) | HCHO | -102.6 |
vinyl chloride (chloroethene) | CH2CHCl | 51.5 |
bromochlorofluoroiodomethane | CBrCIFI | 125.2 |
bromomethane | CH3Br | -25 |
1,3-butadien | C4H6 | 152.5 |
chloroethane | C2H5Cl | -60.3 |
methanethiol | CH4S | -9.3 |
hydrocarbons#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
methane | CH4 | -50.6 |
n-buthane | C4H10 | -16.7 |
ethene (ethylene) | C2H4 | 68.3 |
ethyne | C2H2 | 210.7 |
benzene | C6H6 | 123.8 |
orthoxylene | C6H4(CH3)2 | 110 |
metaxylene | C6H4(CH3)2 | 109.6 |
paraxylene | C6H4(CH3)2 | 108.5 |
n-octane | C8H18 | 6.6 |
naphthalene | C10H8 | 200.9 |
antracene | C14H10 | 285.9 |
1,3-butadien | C4H6 | 152.5 |
phenols#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
phenol | C6H5OH | 183.9 |
carboxylic acids#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
formic acid | HCOOH | -347 |
lactic acid | CH3CH(OH)COOH | -518.1 |
oxalic acid | (COOH)2 | -701.7 |
acetate acid | CH3COOH | -389 |
propionic acid | CH3CH2COOH | -384.6 |
salicylic acid | OHC6H4COOH | 427 |
benzoic acid | C6H5COOH | -245.3 |
butter acid | CH3CH2CH2COOH | -377.3 |
palmitic acid | C15H31COOH | -316 |
stearic acid | C17H35COOH | -36 |
succinic acid | HOOC(CH2)2COOH | -744.5 |
fumaric acid | HOOCCHCHCOOH | -654.2 |
maleic acid | HOOCCHCHCOOH | -629.8 |
phthalic acid | C6H4(COOH)2 | -591 |
solids#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
oxalic acid | (COOH)2 | -701.7 |
salicylic acid | OHC6H4COOH | 427 |
benzoic acid | C6H5COOH | -245.3 |
naphthalene | C10H8 | 200.9 |
antracene | C14H10 | 285.9 |
palmitic acid | C15H31COOH | -316 |
stearic acid | C17H35COOH | -36 |
succinic acid | HOOC(CH2)2COOH | -744.5 |
fumaric acid | HOOCCHCHCOOH | -654.2 |
maleic acid | HOOCCHCHCOOH | -629.8 |
phthalic acid | C6H4(COOH)2 | -591 |
urea (carbonyl diamide) | CO(NH2)2 | -203.5 |
acetamide | CH3CONH2 | 191.4 |
ß-D-glucose | C6H12O6 | -909.3 |
saccharose | C12H22O11 | -1548.1 |
phthalic anhydride | C8H4O3 | -331 |
biphenyl | C12H10 | 253.2 |
glycine | C2H5NO2 | -373.7 |
citric acid | C6H8O7 | -1422.4 |
sodium acetate | C2H3O2Na | -608.8 |
other organic#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
benzaldehyde | C6H5COH | 6.4 |
chlorobenzene | C6H5Cl | 94 |
bromobenzene | C6H5Br | 112.3 |
pyridine | C5H5N | 158.4 |
diethyl ethere | (C2H5)2O | -116.3 |
formaldehyde (methanal) | HCHO | -102.6 |
nitromethane | CH3NO2 | 6.5 |
nitrobenzene | C6H5NO2 | 140 |
vinyl chloride (chloroethene) | CH2CHCl | 51.5 |
acetamide | CH3CONH2 | 191.4 |
ß-D-glucose | C6H12O6 | -909.3 |
saccharose | C12H22O11 | -1548.1 |
acetonitrile | C2H3N | 88.8 |
acetylacetone | C5H8O2 | -306.9 |
benzonitrile | C7H5N | 258.1 |
phthalic anhydride | C8H4O3 | -331 |
acetic anhydride | C4H6O3 | -488.6 |
biphenyl | C12H10 | 253.2 |
bromochlorofluoroiodomethane | CBrCIFI | 125.2 |
bromoethane | C2H5Br | -26.1 |
bromomethane | CH3Br | -25 |
chloroethane | C2H5Cl | -60.3 |
glycine | C2H5NO2 | -373.7 |
citric acid | C6H8O7 | -1422.4 |
methyl methacrylate | C5H8O2 | -225 |
methanethiol | CH4S | -9.3 |
N-methylaniline | C7H9N | 178.1 |
amines#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
methylamine | CH3NH2 | 29.6 |
phenylamine (aniline) | C6H5NH2 | 146.3 |
esters#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
ethyl acetate | CH3COOC2H5 | -328.1 |
methyl formate | C2H4O2 | -300.2 |
other inorganic#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
urea (carbonyl diamide) | CO(NH2)2 | -203.5 |
salts#
Substance | Molecular formula | Standard free enthalpy of creation ΔG0 [kJ/mol] |
sodium acetate | C2H3O2Na | -608.8 |
Some facts#
- Free enthalpy is defined as:
where:
- G - free enthalpy,
- U - internal energy,
- p - pressure,
- V - volume,
- T - temperature,
- S - entropy.
- G - free enthalpy,
- The relationship between enthalpy and free enthalpy is as follows:
where:
- G - free enthalpy,
- H - enthalpy,
- T - temperature,
- S - entropy.
- G - free enthalpy,
- Free enthalpy is also called the Gibbs function or Gibbs free energy.
- Free enthalpy is usually marked with the symbol G or g.
- The standard free enthalpy applies to the so-called standard conditions i.e. pressure 1013,25 hPa and temperature 25 °C.
- Basing on enthalpy and entropy or reaction we can calculate its free enthalpy:
where:
- - free enthalpy of reaction,
- - enthalpy of reaction,
- - entropy of reaction,
- - temperature.
- - free enthalpy of reaction,
- If the free enthalpy of reaction is negative, then it runs spontaneously.
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