Formula |
C13H19NOS |
IUPAC Name |
3-(4-butoxyphenyl)propanethioamide |
Molecular Mass |
237.361 g·mol−1 |
Heat of Formation |
-122.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.81 ± 1.08 D |
Volume |
310.0 Å 3 |
Surface Area |
296.76 Å 2 |
HOMO Energy |
-8.49 ± 0.55 eV |
LUMO Energy |
-0.73 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 3-(4-butoxyphenyl)propyl thioamide
- 3-(4-butoxyphenyl)thiopropionamide
- boppt
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CAS Number(s) |
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InChIKey |
DURVNLQXOMHJMY-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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