- Formula: C7D8
- Molecular weight: 100.1877
- IUPAC Standard InChI:
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- IUPAC Standard InChIKey: YXFVVABEGXRONW-JGUCLWPXSA-N
- CAS Registry Number: 2037-26-5
- Chemical structure:
This structure is also available as a 2d Mol file
- Other names: Benzene-D5-, methyl-D3-; Perdeuterotoluene; C6D5CD3; (2H8)toluene
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Reaction thermochemistry data
Go To: Top, References, Notes
Data compiled by: John E. Bartmess
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
C7D7- + =
By formula: C7D7- + D+ = C7D8
|rH°||386.44 ± 0.67||kcal/mol||G+TS||Ellison, Davico, et al., 1996||gas phase|
|rG°||377.20 ± 0.30||kcal/mol||IMRE||Ellison, Davico, et al., 1996||gas phase|
Go To: Top, Reaction thermochemistry data, Notes
Ellison, Davico, et al., 1996
Ellison, G.B.; Davico, G.E.; Bierbaum, V.M.; DePuy, C.H., Thermochemistry of theb Benzyl and Allyl Radicals and Ions, Int. J. Mass Spectrom. Ion Proc., 1996, 156, 1-2, 109-131, https://doi.org/10.1016/S0168-1176(96)04383-2 . [all data]
Go To: Top, Reaction thermochemistry data, References
- Symbols used in this document:
rG° Free energy of reaction at standard conditions rH° Enthalpy of reaction at standard conditions
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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