Thiourea, phenyl-
- Formula: C7H8N2S
- Molecular weight: 152.217
- IUPAC Standard InChI: InChI=1S/C7H8N2S/c8-7(10)9-6-4-2-1-3-5-6/h1-5H,(H3,8,9,10)
- IUPAC Standard InChIKey: FULZLIGZKMKICU-UHFFFAOYSA-N
- CAS Registry Number: 103-85-5
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
View 3d structure (requires JavaScript / HTML 5) - Other names: Urea, 1-phenyl-2-thio-; α-Phenylthiourea; N-Phenylthiourea; Phenylthiocarbamide; Phenylthiourea; PTU; U 6324; 1-Phenyl-2-Thiourea; 1-Phenylthiourea; NCI-C02017; USAF EK-1569; Fenylthiomocovina; Rcra waste number P093; NSC 5779; Phenyl-2-thiourea; Thiourea, N-phenyl-
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Gas phase ion energetics data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Ionization energy determinations
| IE (eV) | Method | Reference |
|---|---|---|
| 8.10 | EI | Baldwin, Loudon, et al., 1976 |
Appearance energy determinations
| Ion | AE (eV) | Other Products | Method | Reference | Comment |
|---|---|---|---|---|---|
| C7H7N2S+ | 9.65 | H | EI | Baldwin, Loudon, et al., 1976 |
UV/Visible spectrum
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Spectrum
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Additional Data
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| Source | Smith and Williams, 1961 |
|---|---|
| Owner | INEP CP RAS, NIST OSRD Collection (C) 2007 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
| Origin | INSTITUTE OF ENERGY PROBLEMS OF CHEMICAL PHYSICS, RAS |
| Source reference | RAS UV No. 13736 |
| Instrument | Unicam SP 600 |
| Melting point | 154 |
References
Go To: Top, Gas phase ion energetics data, UV/Visible spectrum, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Baldwin, Loudon, et al., 1976
Baldwin, M.A.; Loudon, A.G.; Maccoll, A.; Webb, K.S.,
The nature and fragmentation pathways of the molecular ions of some arylureas, arylthioureas, acetanilides, thioacetanilides and related compounds,
Org. Mass Spectrom., 1976, 11, 1181. [all data]
Smith and Williams, 1961
Smith, R.L.; Williams, R.T.,
J. Med. Chem., 1961, 4, 147. [all data]
Notes
Go To: Top, Gas phase ion energetics data, UV/Visible spectrum, References
- Symbols used in this document:
AE Appearance energy - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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