- Formula: CF2
- Molecular weight: 50.0075
- IUPAC Standard InChI:
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- IUPAC Standard InChIKey: LTVOKYUPTHZZQH-UHFFFAOYSA-N
- CAS Registry Number: 2154-59-8
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
- Other names: Calcium difluoride; Difluoromethylene
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Ion clustering data
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Data compiled by: John E. Bartmess
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(CF3- 4294967295) + = CF3-
By formula: (CF3- 4294967295CF2) + CF2 = CF3-
|rH°||208. ± 10.||kJ/mol||N/A||Deyerl, Alconcel, et al., 2001||gas phase; Adiabatic EA, from vibrational structure of spectrum|
|rH°||213. ± 12.||kJ/mol||N/A||Bartmess, Scott, et al., 1979||gas phase; Paulino and Squires, 1991 suggests that this acidity may be too weak by ca. 5 kcal/mol. However, G2 calcn(JEB) give «DELTA»Hacid=379.9, «DELTA»Gacid=372.0; value altered from reference due to change in acidity scale|
|rH°||234. ± 11.||kJ/mol||CIDT||Paulino and Squires, 1991||gas phase; Neutral heat is based on a fluoroform acidity that may be too weak by up to 5 kcal/mol|
Go To: Top, Ion clustering data, Notes
Deyerl, Alconcel, et al., 2001
Deyerl, H.J.; Alconcel, L.S.; Continetti, R.E., Photodetachment imaging studies of the electron affinity of CF3, J. Phys. Chem. A, 2001, 105, 3, 552-557, https://doi.org/10.1021/jp003137k . [all data]
Bartmess, Scott, et al., 1979
Bartmess, J.E.; Scott, J.A.; McIver, R.T., Jr., The gas phase acidity scale from methanol to phenol, J. Am. Chem. Soc., 1979, 101, 6047. [all data]
Paulino and Squires, 1991
Paulino, J.A.; Squires, R.R., Carbene Thermochemistry from Collision-Induced Dissociation Threshold Energy Measurements - The Heats of Formation of X1A1 CF2 and X1A1 CCl2, J. Am. Chem. Soc., 1991, 113, 15, 5573, https://doi.org/10.1021/ja00015a009 . [all data]
Go To: Top, Ion clustering data, References
- Symbols used in this document:
rH° Enthalpy of reaction at standard conditions
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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