| Formula |
C5H7NS |
| IUPAC Name |
(e)-1-isothiocyanatobut-1-ene |
| Molecular Mass |
113.181 g·mol−1 |
| Heat of Formation |
148.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.32 ± 1.08 D |
| Volume |
148.18 Å 3 |
| Surface Area |
164.25 Å 2 |
| HOMO Energy |
-8.75 ± 0.55 eV |
| LUMO Energy |
-1.08 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (e)-1-isothiocyanatobut-1-ene
- [(e)-but-1-enyl]imino-thioxo-methane
- butenyl isothiocyanate
- isothiocyanic acid, 3-butenyl ester
- isothiocyanic acid, butenyl ester
|
| CAS Number(s) |
|
| InChIKey |
XDDPFUCCKIMFOG-ONEGZZNKSA-N |
| QR Code |
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| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
N
|
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