Borane, dichlorophenyl-
- Formula: C6H5BCl2
- Molecular weight: 158.821
- IUPAC Standard InChI: InChI=1S/C6H5BCl2/c8-7(9)6-4-2-1-3-5-6/h1-5H
- IUPAC Standard InChIKey: NCQDQONETMHUMY-UHFFFAOYSA-N
- CAS Registry Number: 873-51-8
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Dichlorophenylborane; Phenylboron dichloride; Phenyldichloroborane; Dichlorophenylboron
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Options:
Phase change data
Go To: Top, Gas phase ion energetics data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: William E. Acree, Jr., James S. Chickos
Enthalpy of vaporization
| ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
|---|---|---|---|---|
| 8.1 ± 0.2 | 296. | T | Finch, Gardner, et al., 1967 | Based on data from 273. to 318. K. |
Gas phase ion energetics data
Go To: Top, Phase change data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
| IE (eV) | Method | Reference | Comment |
|---|---|---|---|
| 9.3 | PE | Ramsey and O'Neill, 1977 | LLK |
| 9.52 | PE | Ramsey and O'Neill, 1977 | Vertical value; LLK |
Appearance energy determinations
| Ion | AE (eV) | Other Products | Method | Reference | Comment |
|---|---|---|---|---|---|
| C6H5BCl+ | 12.88 ± 0.14 | Cl | EI | Lockhart and Kelly, 1968 | RDSH |
References
Go To: Top, Phase change data, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Finch, Gardner, et al., 1967
Finch, Arthur; Gardner, P.J.; Watts, G.B.,
Thermochemistry of the trialkylthioboranes and triphenylthioborane,
Trans. Faraday Soc., 1967, 63, 1603, https://doi.org/10.1039/tf9676301603
. [all data]
Ramsey and O'Neill, 1977
Ramsey, B.G.; O'Neill, S.J.,
A comparison of modified CNDO/2 calculations and the photoelectron, NMR, and UV spectroscopic properties of boron- substituted monophenylboranes,
J. Organomet. Chem., 1977, 141, 257. [all data]
Lockhart and Kelly, 1968
Lockhart, J.C.; Kelly, P.,
Mass spectrum of phenylboron dichloride and the ionic bond energy D(PhBCl+Cl-),
Intern. J. Mass Spectrom. Ion Phys., 1968, 1, 209. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, References
- Symbols used in this document:
AE Appearance energy ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.